Ligand: AGS

Total number of chains: 42
Active chains: 3
Total number of genes: 17
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 16 38.1% 9MMQA
DFGin BLAminus 14 33.3% 7AKMA
None None 5 11.9% 3W8QA
DFGin ABAminus 2 4.8% 6TSZU
DFGin None 2 4.8% 5C03A
DFGout None 2 4.8% 2G2FB
DFGinter None 1 2.4% 2W5BA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
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Group Gene SwissprotID PDB UniprotID First_obs_res Last_obs_res Length_Unp Ligand Ligand_type Activity_label Spatial_label Phe_Glu4_dis Phe_Lys_dis Dihedral_label XDFG
φ,ψ		 DFG-Asp
φ,ψ		 DFG-Phe
φ,ψ		 DFG-Phe
χ1,χ2		 DFG-Gly
φ,ψ		 ChelixSaltbr_label Chelix_label Lys_Glu_dis Saltbr_label LysNZ_GluOE_dis HRD_label His φ,ψ Arg φ,ψ SNC_label SNCpymol_label ActLoop_label ActLoopNT_label DFG6_XHRD_dis ActLoopCT_label APEtype APEdihe_label APEdist_label APE10_dihe_label APE10 φ,ψ APE9_dihe_label APE9 φ,ψ APE8_dihe_label APE8 φ,ψ APE8_rotamer_label APE8 χ1 APE67_label APE6 φ,ψ APE7 φ,ψ APE12_dist_label APE12_DFG4_dis APE11_dist_label APE11_DFG4_dis APE10_dist_label APE10_DFG4_dis APE9_dist_label APE9_Arg_dis Chain_mut Chain_phos Modified_aa Method Resolution Rvalue FreeRvalue Chain_id ChainLen Ordered_residues DomainBreak ActLoopLength ActLoopResolvedResidues ActLoopDisorderedResidues Kinase_domains_Unp N_Kinase_domains_Unp pdb Kincore_name hmm Evalue Score hmmbeg hmmend hmmlen XDFGnum DFGnum PHEnum DFG4num DFG6num LYSnum GLUnum GLU4num XHRDnum ARGnum HRDnum HRDaspnum aFaspnum APEnum APE6num APE7num APE8num APE9num APE10num APE11num APE12num Hinge1num Protein_name
AGC PKN2 PKN2_HUMAN 4CRSA Q16513 646 984 984.0 AGS:61985 ATPlike Inactive DFGin 6.1564 12.7634 BLAminus -120.55, 175.31 66.4, 80.82 -96.2, 27.19 310.22, 114.46 -62.58, -30.59 in-in in 9.266 Saltbr-in 2.7477 HRD-in -80.04, -60.18 72.41, -11.14 in-in-out SNCiio in-out ActLoopNT-in 2.9879 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -156.69, 159.24 APE9-dihe-na 123.16, -174.45 APE8-dihe-in -102.24, 141.6 APE8-rot-out 48.54 APE67-dihe-in -62.99, -37.09 -38.53, -44.47 APE12-dist-in 7.9841 APE11-dist-in 11.144 APE10-dist-in 5.8598 APE9-dist-in 4.1205 None SEP755,TPO816,TPO958 SEP755,TPO816,TPO958 XRAY 2.75 0.213 0.262 A 341.0 332.0 0 28 28 0 [[657, 916]] 1.0 4crs AGC_PKN2_HUMAN AGC 1.2e-93 318.9 1.0 260.0 260.0 799 800 801 803 805 686 705 709 779 781 780 782.0 839 827 822 821 820 819 818 817 816 738 Serine/threonine-protein kinase N2
CAMK CHEK1 CHK1_HUMAN 7AKMA O14757 2 271 476.0 AGS:401 ATPlike Active DFGin 6.7746 14.1434 BLAminus -128.66, 150.55 71.15, 96.3 -103.32, 28.49 292.74, 82.8 -70.74, -21.81 in-in in 9.111 Saltbr-in 2.7059 HRD-in -78.28, -45.32 76.75, -0.14 in-in-in SNCiii in-in ActLoopNT-in 3.0115 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -163.43, 171.3 APE9-dihe-na 110.38, -147.97 APE8-dihe-in -135.73, 125.59 APE8-rot-in 300.71 APE67-dihe-in -62.97, -17.75 -56.42, -42.48 APE12-dist-in 9.3085 APE11-dist-in 11.6735 APE10-dist-in 6.1706 APE9-dist-in 3.4066 D10R None None XRAY 1.93 0.199 0.242 A 298.0 270.0 0 30 30 0 [[9, 265]] 1.0 7akm CAMK_CHEK1_HUMAN CAMK 3.4e-71 245.5 2.0 256.0 255.0 147 148 149 151 153 38 55 59 127 129 128 130.0 190 177 172 171 170 169 168 167 166 85 Serine/threonine-protein kinase Chk1
CMGC CDK7 CDK7_HUMAN 6XBZJ P50613 10 312 346.0 AGS:402 ATPlike Inactive DFGin 6.5749 15.4027 ABAminus -82.2, -66.45 -124.23, 139.62 -119.21, 25.52 290.81, 70.1 -71.19, -16.45 in-out in 8.0 Saltbr-out 4.8 HRD-out -77.12, 93.04 -84.92, 20.14 out-in-in SNCoii in-in ActLoopNT-in 2.8045 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -98.95, 83.93 APE9-dihe-na -171.97, 152.98 APE8-dihe-in -55.47, 134.49 APE8-rot-in 286.18 APE67-dihe-in -62.05, -27.13 -54.66, -43.29 APE12-dist-in 13.3556 APE11-dist-in 11.0349 APE10-dist-in 6.0348 APE9-dist-in 3.3428 None SEP164 SEP164 EM 2.8 999.0 999.0 J 391.0 298.0 5 28 28 0 [[12, 295]] 1.0 6xbz CMGC_CDK7_HUMAN CMGC 2.4e-78 271.1 1.0 301.0 301.0 154 155 156 158 160 41 62 66 134 136 135 137.0 195 182 177 176 175 174 173 172 171 92 Cyclin-dependent kinase 7
CMGC CDK7 CDK7_HUMAN 8P6YJ P50613 10 310 346.0 AGS:60401 ATPlike Inactive DFGin 6.8248 15.586 BLAminus -141.03, -177.14 58.28, 66.28 -86.35, 22.83 281.11, 73.93 -65.68, -18.8 in-out in 8.4298 Saltbr-out 4.9403 HRD-in -69.3, -48.75 64.3, 11.38 out-in-in SNCoii in-in ActLoopNT-in 2.7938 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -124.65, 164.79 APE9-dihe-na 67.53, 137.74 APE8-dihe-in -59.47, 143.7 APE8-rot-in 312.32 APE67-dihe-in -62.79, -23.75 -56.89, -39.97 APE12-dist-in 13.3135 APE11-dist-in 11.0418 APE10-dist-in 6.6455 APE9-dist-in 3.274 None None None EM 1.9 999.0 999.0 J 349.0 286.0 15 28 28 0 [[12, 295]] 1.0 8p6y CMGC_CDK7_HUMAN CMGC 1.6e-78 271.7 1.0 301.0 301.0 154 155 156 158 160 41 62 66 134 136 135 137.0 195 182 177 176 175 174 173 172 171 92 Cyclin-dependent kinase 7
CMGC CDK7 CDK7_HUMAN 9HIYJ P50613 10 310 346.0 AGS:60401 ATPlike Active DFGin 6.7269 15.7177 BLAminus -144.39, -174.23 58.17, 64.72 -87.83, 23.91 281.92, 72.77 -77.85, -11.75 in-in in 8.5421 Saltbr-in 3.5 HRD-in -67.31, -50.64 65.74, 8.28 in-in-in SNCiii in-in ActLoopNT-in 2.7332 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.25, 164.09 APE9-dihe-na 67.64, 142.62 APE8-dihe-in -59.57, 146.87 APE8-rot-in 317.63 APE67-dihe-in -64.96, -18.05 -61.86, -38.17 APE12-dist-in 13.5793 APE11-dist-in 11.3215 APE10-dist-in 6.933 APE9-dist-in 3.3515 D97N None None EM 2.3 999.0 999.0 J 349.0 287.0 14 28 25 3 [[12, 295]] 1.0 9hiy CMGC_CDK7_HUMAN CMGC 1.8e-78 271.6 1.0 301.0 301.0 154 155 156 158 160 41 62 66 134 136 135 137.0 195 182 177 176 175 174 173 172 171 92 Cyclin-dependent kinase 7
NEK NEK2 NEK2_HUMAN 2W5BA P51955 3 271 445.0 AGS:61280 ATPlike Inactive DFGinter 8.5035 5.6928 None -133.84, 63.71 -87.34, 106.84 -95.06, 50.42 207.49, 72.2 -49.75, -30.44 out-out out 12.5887 Saltbr-out 12.7626 HRD-out -82.64, 121.7 -138.12, 47.77 out-out-out SNCooo out-out ActLoopNT-out 12.438 ActLoopCT-out nonTYR APEdihe_aaiio APEdist_oooo APE10-dihe-na -74.41, -42.54 APE9-dihe-na -62.33, 153.14 APE8-dihe-in -108.21, 120.03 APE8-rot-in 313.31 APE67-dihe-out -53.46, -34.47 -75.96, 66.07 APE12-dist-out 14.0599 APE11-dist-out 18.7846 APE10-dist-out 19.3977 APE9-dist-out 15.8788 T175A None None XRAY 2.4 0.186 0.245 A 279.0 263.0 6 28 28 0 [[8, 271]] 1.0 2w5b NEK_NEK2_HUMAN NEK 3.4e-109 370.2 1.0 256.0 256.0 158 159 160 162 164 37 55 59 138 140 139 141.0 198 186 181 180 179 178 177 176 175 87 Serine/threonine-protein kinase Nek2
OTHER TLK2 TLK2_HUMAN 5O0YA Q86UE8 456 743 772.0 AGS:801 ATPlike Inactive DFGin 5.8382 16.6964 BLAminus -154.54, -173.82 64.72, 68.79 -84.13, 30.07 299.95, 83.25 -66.33, -38.04 out-out out 11.511 Saltbr-out 5.9716 HRD-out -83.23, 94.84 -74.56, -13.23 out-in-in SNCoii in-in ActLoopNT-in 2.8579 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -69.76, 159.55 APE9-dihe-na 89.86, 175.53 APE8-dihe-in -96.42, 113.01 APE8-rot-in 322.47 APE67-dihe-in -58.01, -37.07 -65.88, -24.96 APE12-dist-in 12.0821 APE11-dist-in 11.0119 APE10-dist-in 6.4189 APE9-dist-in 5.7404 None None None XRAY 2.86 0.184 0.21 A 579.0 288.0 0 35 35 0 [[462, 741]] 1.0 5o0y OTHER_TLK2_HUMAN CAMK 6.6e-54 190.4 1.0 256.0 256.0 612 613 614 616 618 491 514 518 589 591 590 592.0 663 647 642 641 640 639 638 637 636 545 Serine/threonine-protein kinase tousled-like 2
OTHER ULK4 ULK4_HUMAN 6TSZU Q96C45 2 285 1275.0 AGS:60301 ATPlike Pseudo DFGin 6.3704 18.2708 ABAminus -125.81, 9.4 -156.01, 117.6 -115.95, 19.15 288.81, 81.65 -56.0, -43.19 out-na out 14.2882 Saltbr-na 999.0 HRD-in -78.74, -35.33 74.51, -30.17 na-in-out SNCaio in-out ActLoopNT-in 2.7475 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -74.27, 133.36 APE9-dihe-na -108.57, -165.46 APE8-dihe-in -71.23, 118.04 APE8-rot-in 324.52 APE67-dihe-in -65.15, -30.07 -62.89, -23.31 APE12-dist-in 8.5787 APE11-dist-out 6.171 APE10-dist-out 9.1817 APE9-dist-in 5.697 None None None XRAY 1.9 0.203 0.253 U 305.0 283.0 1 51 50 1 [[4, 280]] 1.0 6tsz OTHER_ULK4_HUMAN ULK 1.2e-118 401.1 1.0 256.0 256.0 138 139 140 142 144 34 46 50 118 120 119 121.0 201 189 184 183 182 181 180 179 178 76 Serine/threonine-protein kinase ULK4
STE MAP2K1 MP2K1_HUMAN 3EQDA Q02750 39 382 393.0 AGS:2 ATPlike Inactive DFGin 5.9616 14.1078 BLBplus -148.22, 169.15 61.13, 42.77 -94.74, 116.91 42.1, 90.93 -43.97, 123.65 out-out out 15.0819 Saltbr-out 14.8735 HRD-in -61.74, -59.42 83.27, -18.79 out-out-out SNCooo out-out ActLoopNT-out 10.9097 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oooo APE10-dihe-na -139.36, 111.64 APE9-dihe-na -74.03, 166.79 APE8-dihe-in -61.05, 144.18 APE8-rot-out 194.8 APE67-dihe-in -63.95, -10.98 -107.09, 3.75 APE12-dist-out 19.9512 APE11-dist-out 15.017 APE10-dist-out 16.7322 APE9-dist-out 9.444 S298N,S299K,Y300F None None XRAY 2.1 0.211 999.0 A 360.0 315.0 29 26 26 0 [[68, 361]] 1.0 3eqd STE_MAP2K1_HUMAN STE 1.8e-97 331.7 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 8DGSB Q02750 38 383 393.0 AGS:60801,LCJ:60803 ATPlike,Type1 Inactive DFGin 6.249 12.9971 BLBplus -155.73, -179.02 61.68, 27.26 -72.39, 155.67 44.5, 85.53 -87.2, 64.42 out-out out 16.2947 Saltbr-out 16.06 HRD-in -62.57, -46.0 64.99, -4.53 out-out-out SNCooo out-out ActLoopNT-out 8.7094 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -122.25, 153.26 APE9-dihe-na -110.07, 177.24 APE8-dihe-out -99.46, -47.43 APE8-rot-out 69.24 APE67-dihe-out -133.48, 170.62 -132.77, 150.72 APE12-dist-out 17.1114 APE11-dist-out 20.5769 APE10-dist-out 22.9193 APE9-dist-out 13.2707 S218A,S222A None None EM 4.3 999.0 999.0 B 414.0 314.0 32 26 26 0 [[68, 361]] 1.0 8dgs STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 8DGTB Q02750 43 385 393.0 AGS:60402,LCJ:60403 ATPlike,Type3 Inactive DFGin 5.9682 13.5357 BLBplus -152.99, 179.37 55.42, 45.61 -100.12, 157.06 44.99, 96.32 -80.94, 77.56 out-out out 15.5691 Saltbr-out 15.7331 HRD-in -64.15, -51.45 68.84, -11.98 out-out-out SNCooo out-out ActLoopNT-out 8.9452 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -67.75, 131.31 APE9-dihe-na -82.42, -172.83 APE8-dihe-out -101.84, -12.18 APE8-rot-out 77.74 APE67-dihe-out -124.11, 144.61 -162.74, 152.77 APE12-dist-out 16.6735 APE11-dist-out 21.6272 APE10-dist-out 23.2855 APE9-dist-out 13.7054 S218A,S222A None None EM 3.9 999.0 999.0 B 414.0 311.0 32 26 26 0 [[68, 361]] 1.0 8dgt STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 9MMPB Q02750 62 380 393.0 AGS:60701,LCJ:60702 ATPlike,Type3 Inactive DFGin 6.4937 13.7015 BLBplus -142.17, 163.3 59.56, 65.37 -113.14, 157.69 39.56, 95.33 -79.99, 73.26 out-out out 15.7564 Saltbr-out 16.3325 HRD-in -69.63, -60.91 71.6, -9.27 out-out-out SNCooo out-out ActLoopNT-out 8.0011 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na -73.57, 130.1 APE9-dihe-na -94.62, 178.33 APE8-dihe-out -96.1, -46.02 APE8-rot-in 278.39 APE67-dihe-out -136.63, 147.99 -117.77, 157.18 APE12-dist-out 17.2275 APE11-dist-out 22.2405 APE10-dist-out 24.3959 APE9-dist-out 13.7692 S218A,S222A None None EM 3.4 999.0 999.0 B 415.0 279.0 40 26 26 0 [[68, 361]] 1.0 9mmp STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 9MMQB Q02750 62 380 393.0 AGS:701,LCJ:703 ATPlike,Type3 Inactive DFGin 6.6749 13.4889 BLBplus -138.6, 170.41 60.57, 44.79 -97.28, 158.99 35.24, 93.11 -75.64, 83.14 out-out out 15.4214 Saltbr-out 15.6346 HRD-in -61.2, -52.92 69.79, -9.3 out-out-out SNCooo out-out ActLoopNT-out 9.0103 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na -65.78, 148.58 APE9-dihe-na -99.52, -176.8 APE8-dihe-out -104.42, -44.51 APE8-rot-in 299.56 APE67-dihe-out -150.89, 153.99 -135.56, 174.2 APE12-dist-out 17.2664 APE11-dist-out 22.0929 APE10-dist-out 24.0771 APE9-dist-out 13.54 S218A,S222A None None EM 2.9 999.0 999.0 B 415.0 279.0 40 26 26 0 [[68, 361]] 1.0 9mmq STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 9MMRB Q02750 62 380 393.0 AGS:60701,LCJ:60703 ATPlike,Type3 Inactive DFGin 6.847 13.5448 BLBplus -144.47, 166.22 62.86, 45.64 -102.79, 155.22 38.56, 95.23 -78.03, 72.6 out-out out 15.3255 Saltbr-out 15.7338 HRD-in -59.38, -50.94 68.52, -2.49 out-out-out SNCooo out-out ActLoopNT-out 8.9519 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na -61.82, 155.36 APE9-dihe-na -107.83, -179.82 APE8-dihe-out -105.89, -53.41 APE8-rot-in 308.85 APE67-dihe-out -136.82, 148.35 -127.86, 156.49 APE12-dist-out 17.0348 APE11-dist-out 22.0064 APE10-dist-out 24.0306 APE9-dist-out 13.5803 S218A,S222A None None EM 3.9 999.0 999.0 B 415.0 279.0 40 26 26 0 [[68, 361]] 1.0 9mmr STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 9MMSB Q02750 63 380 393.0 AGS:701,LCJ:703 ATPlike,Type3 Inactive DFGin 6.8547 13.563 BLBplus -141.52, 164.23 63.42, 46.21 -99.5, 165.31 34.19, 90.42 -80.53, 73.26 out-out out 15.4077 Saltbr-out 15.7694 HRD-in -66.2, -52.71 70.98, -11.79 out-out-out SNCooo out-out ActLoopNT-out 8.8575 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na -63.41, 150.0 APE9-dihe-na -102.92, -178.46 APE8-dihe-out -108.1, -35.69 APE8-rot-in 324.75 APE67-dihe-out -152.78, 143.47 -133.76, 175.52 APE12-dist-out 17.2823 APE11-dist-out 22.2166 APE10-dist-out 24.3527 APE9-dist-out 13.6751 S218A,S222A None None EM 3.3 999.0 999.0 B 415.0 278.0 40 26 26 0 [[68, 361]] 1.0 9mms STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 3EQCA Q02750 39 382 393.0 3BM:1,AGS:2 Type3,ATPlike Inactive DFGin 6.1057 13.8617 BLBplus -138.12, -177.12 54.65, 30.92 -83.74, 156.51 44.84, 87.16 -79.52, 70.22 out-out out 15.3111 Saltbr-out 14.7046 HRD-in -64.92, -56.9 85.6, -17.06 out-out-out SNCooo out-out ActLoopNT-out 9.3671 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnoo APE10-dihe-na 999.0, 106.4 APE9-dihe-na -87.03, 145.5 APE8-dihe-in -52.92, 140.89 APE8-rot-out 198.88 APE67-dihe-in -66.8, -13.13 -101.4, 5.04 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 19.4624 APE9-dist-out 9.4427 S298N,S299K,Y300F None None XRAY 1.8 0.201 0.235 A 360.0 312.0 32 26 23 3 [[68, 361]] 1.0 3eqc STE_MAP2K1_HUMAN STE 1.8e-97 331.7 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 3W8QA Q02750 39 382 393.0 AGS:401 ATPlike Inactive None 13.1078 15.1223 None -61.95, 160.72 -84.08, 71.5 -96.94, 162.22 62.16, 97.76 71.69, 28.05 out-out out 16.278 Saltbr-out 14.58 HRD-out -76.9, 112.47 -115.43, 103.34 out-out-out SNCooo out-out ActLoopNT-out 11.4785 ActLoopCT-out nonTYR APEdihe_aaioo APEdist_oooo APE10-dihe-na -85.42, 139.56 APE9-dihe-na 64.92, 170.12 APE8-dihe-in -109.26, 128.33 APE8-rot-out 42.71 APE67-dihe-out -157.09, 132.41 -146.54, 166.67 APE12-dist-out 15.6567 APE11-dist-out 20.9119 APE10-dist-out 24.1063 APE9-dist-out 32.1107 T292A,S298A None None XRAY 2.2 0.201 0.268 A 350.0 318.0 26 26 26 0 [[68, 361]] 1.0 3w8q STE_MAP2K1_HUMAN STE 1.6e-97 331.8 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6Q0TC Q02750 43 379 393.0 LCJ:60402,AGS:60403 Type1,ATPlike Inactive None 999.0 999.0 None -140.61, 176.69 54.64, 28.33 -81.67, 161.61 999.0, 999.0 -81.74, 73.01 out-none out 15.4983 Saltbr-none 999.0 HRD-in -63.91, -56.51 90.24, -35.06 none-out-out SNCnoo out-out ActLoopNT-out 9.2901 ActLoopCT-out nonTYR APEdihe_aaono APEdist_oooo APE10-dihe-na -73.68, 137.65 APE9-dihe-na -84.71, 179.02 APE8-dihe-out -112.93, -24.43 APE8-rot-none 999.0 APE67-dihe-out -153.47, 146.62 -142.35, -172.44 APE12-dist-out 17.1555 APE11-dist-out 21.6524 APE10-dist-out 23.7974 APE9-dist-out 13.4988 S218A,S222A None None EM 5.7 999.0 999.0 C 414.0 306.0 31 26 26 0 [[68, 361]] 1.0 6q0t STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6Q0JC Q02750 43 379 393.0 LCJ:60402,AGS:60403 Type1,ATPlike Inactive None 999.0 999.0 None -140.59, 176.71 54.64, 28.27 -81.59, 161.59 999.0, 999.0 -81.72, 72.97 out-none out 15.4979 Saltbr-none 999.0 HRD-in -63.96, -56.51 90.23, -35.02 none-out-out SNCnoo out-out ActLoopNT-out 9.2895 ActLoopCT-out nonTYR APEdihe_aaono APEdist_oooo APE10-dihe-na -73.68, 137.68 APE9-dihe-na -84.7, 179.01 APE8-dihe-out -112.95, -24.41 APE8-rot-none 999.0 APE67-dihe-out -153.48, 146.63 -142.35, -172.44 APE12-dist-out 17.1558 APE11-dist-out 21.6526 APE10-dist-out 23.7977 APE9-dist-out 13.4984 S218A,S222A None None EM 4.9 999.0 999.0 C 415.0 306.0 31 26 26 0 [[68, 361]] 1.0 6q0j STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6Q0JD Q02750 43 379 393.0 LCJ:60402,AGS:60403 Type1,ATPlike Inactive None 999.0 999.0 None -140.57, 176.69 54.62, 28.33 -81.6, 161.59 999.0, 999.0 -81.66, 72.9 out-none out 15.4977 Saltbr-none 999.0 HRD-in -63.9, -56.54 90.23, -35.02 none-out-out SNCnoo out-out ActLoopNT-out 9.2893 ActLoopCT-out nonTYR APEdihe_aaono APEdist_oooo APE10-dihe-na -73.75, 137.67 APE9-dihe-na -84.68, 179.02 APE8-dihe-out -112.95, -24.44 APE8-rot-none 999.0 APE67-dihe-out -153.47, 146.64 -142.36, -172.48 APE12-dist-out 17.1558 APE11-dist-out 21.6536 APE10-dist-out 23.7977 APE9-dist-out 13.4991 S218A,S222A None None EM 4.9 999.0 999.0 D 415.0 306.0 31 26 26 0 [[68, 361]] 1.0 6q0j STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP3K14 M3K14_HUMAN 4DN5A Q99558 332 675 947.0 AGS:1008 ATPlike Inactive DFGin 5.2878 13.1112 BLAminus -131.59, 179.35 60.95, 82.45 -103.29, 32.07 306.31, 92.27 -67.11, -18.8 in-in in 8.6853 Saltbr-in 2.9369 HRD-in -77.9, -57.1 103.31, -30.91 in-in-out SNCiio in-out ActLoopNT-in 2.9712 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_noii APE10-dihe-na -78.44, 154.35 APE9-dihe-na -81.04, -47.74 APE8-dihe-in -132.59, 129.65 APE8-rot-in 312.19 APE67-dihe-in -58.65, -18.81 -60.26, -49.52 APE12-dist-none 999.0 APE11-dist-out 6.5883 APE10-dist-in 7.8559 APE9-dist-in 4.0634 S549D None None XRAY 2.5 0.184 0.222 A 356.0 331.0 13 33 20 13 [[399, 652]] 1.0 4dn5 STE_MAP3K14_HUMAN STE 1.2e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 4DN5B Q99558 333 675 947.0 AGS:1003 ATPlike Inactive DFGin 5.1759 13.4557 BLAminus -145.78, -179.59 62.32, 78.55 -101.18, 33.37 302.78, 88.88 -68.82, -20.54 in-in in 8.7257 Saltbr-in 2.793 HRD-in -71.67, -53.16 96.85, -25.39 in-in-out SNCiio in-out ActLoopNT-in 3.0601 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_noii APE10-dihe-na -71.53, 164.6 APE9-dihe-na -90.39, -50.68 APE8-dihe-in -119.09, 127.96 APE8-rot-in 316.48 APE67-dihe-in -61.89, -23.89 -60.44, -46.4 APE12-dist-none 999.0 APE11-dist-out 7.2725 APE10-dist-in 7.9015 APE9-dist-in 4.3975 S549D None None XRAY 2.5 0.184 0.222 B 356.0 330.0 13 33 20 13 [[399, 652]] 1.0 4dn5 STE_MAP3K14_HUMAN STE 1.2e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 8YHWA Q99558 334 675 947.0 AGS:701 ATPlike Inactive DFGin 5.2236 13.5714 BLAminus -131.51, 179.88 71.5, 78.13 -98.25, 28.21 291.83, 89.59 -66.77, -22.24 in-in in 8.7223 Saltbr-in 2.7921 HRD-in -71.07, -53.99 98.86, -11.92 in-in-out SNCiio in-out ActLoopNT-in 3.0735 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -75.92, 156.14 APE9-dihe-na -80.02, -42.5 APE8-dihe-in -134.73, 129.92 APE8-rot-in 297.24 APE67-dihe-in -59.65, -28.29 -63.54, -48.42 APE12-dist-in 7.9565 APE11-dist-out 7.1447 APE10-dist-in 7.9576 APE9-dist-in 3.9323 None None None XRAY 2.9 0.196 0.241 A 351.0 336.0 6 33 27 6 [[399, 652]] 1.0 8yhw STE_MAP3K14_HUMAN STE 1.1e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 8YHWB Q99558 334 675 947.0 AGS:701 ATPlike Inactive DFGin 5.1974 13.554 BLAminus -130.79, 179.54 70.72, 77.54 -98.72, 28.4 292.26, 88.42 -69.38, -19.05 in-in in 8.709 Saltbr-in 2.7911 HRD-in -71.33, -54.32 99.41, -13.31 in-in-out SNCiio in-out ActLoopNT-in 3.0664 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -76.24, 156.09 APE9-dihe-na -79.79, -42.6 APE8-dihe-in -135.45, 130.6 APE8-rot-in 297.54 APE67-dihe-in -59.47, -28.17 -62.63, -49.6 APE12-dist-in 7.9156 APE11-dist-out 7.1095 APE10-dist-in 7.9837 APE9-dist-in 3.9653 None None None XRAY 2.9 0.196 0.241 B 351.0 335.0 7 33 26 7 [[399, 652]] 1.0 8yhw STE_MAP3K14_HUMAN STE 1.1e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 8YHWC Q99558 334 675 947.0 AGS:701 ATPlike Inactive DFGin 5.2254 13.4003 BLAminus -132.02, 179.38 71.36, 77.79 -98.56, 28.33 292.74, 88.36 -67.25, -21.3 in-in in 8.6175 Saltbr-in 2.7835 HRD-in -71.64, -54.39 97.78, -10.79 in-in-out SNCiio in-out ActLoopNT-in 3.0563 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -76.71, 156.45 APE9-dihe-na -80.42, -42.16 APE8-dihe-in -135.43, 129.92 APE8-rot-in 298.13 APE67-dihe-in -59.95, -27.85 -61.25, -50.21 APE12-dist-in 7.8829 APE11-dist-out 7.1158 APE10-dist-in 7.9268 APE9-dist-in 3.9552 None None None XRAY 2.9 0.196 0.241 C 351.0 335.0 7 33 26 7 [[399, 652]] 1.0 8yhw STE_MAP3K14_HUMAN STE 1.1e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 8YHWD Q99558 334 675 947.0 AGS:701,PE8:703 ATPlike,Allosteric Inactive DFGin 5.2071 13.52 BLAminus -132.04, 179.74 71.06, 78.01 -98.25, 28.04 291.93, 89.49 -68.38, -20.37 in-in in 8.7112 Saltbr-in 2.7954 HRD-in -71.1, -54.2 99.37, -12.6 in-in-out SNCiio in-out ActLoopNT-in 3.0757 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -75.74, 155.59 APE9-dihe-na -80.11, -42.03 APE8-dihe-in -135.61, 130.31 APE8-rot-in 298.0 APE67-dihe-in -60.15, -27.6 -63.0, -48.69 APE12-dist-in 7.8856 APE11-dist-out 7.0875 APE10-dist-in 7.9923 APE9-dist-in 3.9502 None None None XRAY 2.9 0.196 0.241 D 351.0 329.0 13 33 20 13 [[399, 652]] 1.0 8yhw STE_MAP3K14_HUMAN STE 1.1e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
TKL BRAF BRAF_HUMAN 6NYBA P15056 233 738 766.0 AGS:60801 ATPlike Inactive DFGin 5.4979 13.825 BLBplus -130.99, 171.98 57.42, 47.58 -103.38, 154.64 56.0, 92.93 63.13, -128.72 out-out out 13.8238 Saltbr-out 12.6037 HRD-in -73.31, -44.18 67.31, 1.32 out-out-out SNCooo out-out ActLoopNT-out 9.0654 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oooo APE10-dihe-na -162.22, 166.73 APE9-dihe-na 98.18, -110.24 APE8-dihe-in -136.25, 146.51 APE8-rot-out 61.57 APE67-dihe-in -62.67, -27.04 -119.01, -4.59 APE12-dist-out 14.6597 APE11-dist-out 15.6406 APE10-dist-out 13.8824 APE9-dist-out 8.7627 None SEP365,SEP729 SEP365,SEP729 EM 4.1 999.0 999.0 A 805.0 350.0 0 30 30 0 [[457, 716]] 1.0 6nyb TKL_BRAF_HUMAN TKL 1.4e-80 277.0 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL BRAF BRAF_HUMAN 8DGSA P15056 155 738 766.0 AGS:60801 ATPlike Inactive DFGin 6.6063 13.2375 BLBplus -138.09, -166.17 58.48, 64.88 -134.87, 173.46 48.16, 90.78 58.1, -132.32 out-out out 14.5219 Saltbr-out 12.2584 HRD-in -71.36, -47.09 71.02, -12.92 out-out-out SNCooo out-out ActLoopNT-out 9.5544 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -160.2, 161.72 APE9-dihe-na 103.44, -137.95 APE8-dihe-in -102.25, 169.61 APE8-rot-in 312.72 APE67-dihe-in -64.56, -41.44 -121.48, -15.09 APE12-dist-out 14.0817 APE11-dist-out 15.8432 APE10-dist-out 12.4597 APE9-dist-out 8.209 None SEP365,SEP729 SEP365,SEP729 EM 4.3 999.0 999.0 A 805.0 427.0 0 30 30 0 [[457, 716]] 1.0 8dgs TKL_BRAF_HUMAN TKL 1.4e-80 277.0 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL BRAF BRAF_HUMAN 8DGTA P15056 151 738 766.0 AGS:60801 ATPlike Inactive DFGin 5.641 13.6752 BLBplus -132.23, 178.7 56.78, 46.46 -100.79, 153.62 51.93, 96.21 64.7, -132.47 out-out out 13.9231 Saltbr-out 12.693 HRD-in -71.52, -43.55 65.96, -9.54 out-out-out SNCooo out-out ActLoopNT-out 8.9984 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oooo APE10-dihe-na -155.42, 128.83 APE9-dihe-na 147.85, 157.58 APE8-dihe-in -55.44, 116.98 APE8-rot-out 39.4 APE67-dihe-in -65.02, -24.91 -67.41, -12.47 APE12-dist-out 14.3676 APE11-dist-out 14.5426 APE10-dist-out 11.9345 APE9-dist-out 6.4575 None SEP365,SEP729 SEP365,SEP729 EM 3.9 999.0 999.0 A 805.0 431.0 0 30 30 0 [[457, 716]] 1.0 8dgt TKL_BRAF_HUMAN TKL 1.4e-80 277.0 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL BRAF BRAF_HUMAN 8VYPC P15056 363 733 766.0 AGS:801 ATPlike Inactive None 999.0 999.0 None 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 in-out in 8.9984 Saltbr-out 6.5941 HRD-in -95.64, -57.28 53.13, 41.02 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none 999.0, 999.0 999.0, 999.0 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 V600E SEP365,SEP729 SEP365,SEP729 EM 3.29 999.0 999.0 C 767.0 171.0 110 30 0 30 [[457, 716]] 1.0 8vyp TKL_BRAF_HUMAN TKL 1.3e-80 277.0 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL IRAK3 IRAK3_HUMAN 6ZIWI Q9Y616 153 451 596.0 AGS:501 ATPlike Pseudo DFGin 7.0579 15.4303 BLAminus -137.94, 171.27 73.33, 92.98 -113.57, 22.08 299.33, 103.06 -63.05, -21.88 in-out in 8.7771 Saltbr-out 6.0762 HRD-in -68.03, -51.72 91.9, -24.04 out-in-none SNCoin in-none ActLoopNT-in 2.6374 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -65.65, -29.02 999.0, 37.66 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None XRAY 2.18 0.218 0.25 I 316.0 267.0 32 34 15 19 [[164, 445]] 1.0 6ziw TKL_IRAK3_HUMAN TKL 2.1e-70 243.3 4.0 266.0 263.0 310 311 312 314 316 192 212 216 290 292 291 293.0 356 344 339 338 337 336 335 334 333 242 Interleukin-1 receptor-associated kinase 3
TKL LIMK1 LIMK1_HUMAN 5L6WL P53667 330 633 647.0 AGS:60701 ATPlike Active DFGin 6.2348 14.3373 BLAminus -131.64, -166.52 46.75, 81.93 -92.83, 15.71 304.28, 98.92 -42.69, -49.84 in-in in 7.6644 Saltbr-in 2.6698 HRD-in -78.67, -47.86 69.62, -13.12 in-in-in SNCiii in-in ActLoopNT-in 3.0656 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -134.6, 165.2 APE9-dihe-na 100.19, 162.86 APE8-dihe-in -63.5, 131.5 APE8-rot-na 185.1 APE67-dihe-in -61.44, -31.47 -69.46, -29.71 APE12-dist-in 9.1162 APE11-dist-in 11.1338 APE10-dist-in 5.4376 APE9-dist-in 3.7616 None None None XRAY 2.53 0.229 0.284 L 310.0 288.0 16 42 26 16 [[339, 606]] 1.0 5l6w TKL_LIMK1_HUMAN TKL 4.5e-77 265.1 3.0 266.0 264.0 477 478 479 481 483 368 384 388 457 459 458 460.0 531 519 514 513 512 511 510 509 508 414 LIM domain kinase 1
TKL MAP3K21 M3K21_HUMAN 4UYAA Q5TCX8 115 437 1036.0 AGS:1438 ATPlike Inactive DFGin 6.4628 13.9984 BLBplus -133.24, 174.99 55.83, 68.25 -140.94, 164.55 55.9, 82.39 72.5, 999.0 in-none in 9.8853 Saltbr-none 999.0 HRD-in -81.83, -51.37 74.29, 7.17 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aanni APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, -67.17 APE8-rot-none 999.0 APE67-dihe-in -51.82, -45.19 -73.69, -16.84 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 A214G,S303A,T307A None None XRAY 2.8 0.204 0.261 A 340.0 274.0 29 26 11 15 [[124, 400]] 1.0 4uya TKL_MAP3K21_HUMAN TKL 1.2e-89 306.3 1.0 266.0 266.0 288 289 290 292 294 151 171 175 260 262 261 263.0 326 314 309 308 307 306 305 304 303 201 Mitogen-activated protein kinase kinase kinase 21
TKL RAF1 RAF1_HUMAN 9MMRA P04049 343 625 648.0 AGS:60701 ATPlike Inactive DFGin 5.4464 13.6261 BLBplus -135.09, 172.16 58.87, 36.16 -92.53, 159.81 52.16, 102.21 63.65, -134.37 out-out out 13.8632 Saltbr-out 12.3622 HRD-out -74.45, 80.03 -68.85, 163.44 out-out-out SNCooo out-out ActLoopNT-out 8.7183 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -153.07, 160.07 APE9-dihe-na 91.95, -174.93 APE8-dihe-in -63.61, 140.51 APE8-rot-in 299.95 APE67-dihe-in -59.35, -38.77 -86.72, -25.37 APE12-dist-out 15.0543 APE11-dist-out 14.7515 APE10-dist-out 11.0339 APE9-dist-out 8.4046 Q156R,Y340D,Y341D,D587E SEP621 SEP621 EM 3.9 999.0 999.0 A 681.0 283.0 0 30 30 0 [[349, 608]] 1.0 9mmr TKL_RAF1_HUMAN TKL 2e-80 276.3 3.0 266.0 264.0 485 486 487 489 491 375 393 397 465 467 466 468.0 530 515 510 509 508 507 506 505 504 422 RAF proto-oncogene serine/threonine-protein kinase
TKL RAF1 RAF1_HUMAN 9MMSA P04049 343 610 648.0 AGS:701 ATPlike Inactive DFGin 6.0432 13.4123 BLBplus -130.72, 176.22 57.09, 37.64 -95.88, 150.42 38.9, 90.55 70.15, -138.14 out-out out 13.239 Saltbr-out 11.9633 HRD-out -75.89, 77.72 -68.75, 167.65 out-out-out SNCooo out-out ActLoopNT-out 9.0132 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -153.3, 137.93 APE9-dihe-na 117.05, 178.36 APE8-dihe-in -66.7, 143.78 APE8-rot-in 289.18 APE67-dihe-in -66.49, -26.11 -89.17, -21.29 APE12-dist-out 15.1652 APE11-dist-out 14.8651 APE10-dist-out 10.7824 APE9-dist-out 8.09 Q156R,Y340D,Y341D,D587E None None EM 3.3 999.0 999.0 A 681.0 268.0 0 30 30 0 [[349, 608]] 1.0 9mms TKL_RAF1_HUMAN TKL 2e-80 276.3 3.0 266.0 264.0 485 486 487 489 491 375 393 397 465 467 466 468.0 530 515 510 509 508 507 506 505 504 422 RAF proto-oncogene serine/threonine-protein kinase
TKL RAF1 RAF1_HUMAN 9MMQA P04049 341 612 648.0 AGS:701 ATPlike Inactive DFGin 6.0418 13.4878 BLBplus -128.47, 173.58 60.41, 41.33 -95.4, 154.76 40.5, 88.25 68.22, -137.22 out-out out 13.7306 Saltbr-out 12.7147 HRD-out -73.84, 78.36 -65.55, 163.21 out-out-out SNCooo out-out ActLoopNT-out 9.1331 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -154.13, 160.3 APE9-dihe-na 98.38, -176.64 APE8-dihe-in -67.06, 138.58 APE8-rot-in 288.86 APE67-dihe-in -64.64, -31.65 -87.38, -18.69 APE12-dist-out 15.1677 APE11-dist-out 14.4229 APE10-dist-out 10.8266 APE9-dist-out 8.1068 Q156R,D587E None None EM 2.9 999.0 999.0 A 681.0 272.0 0 30 30 0 [[349, 608]] 1.0 9mmq TKL_RAF1_HUMAN TKL 2e-80 276.3 3.0 266.0 264.0 485 486 487 489 491 375 393 397 465 467 466 468.0 530 515 510 509 508 507 506 505 504 422 RAF proto-oncogene serine/threonine-protein kinase
TKL RAF1 RAF1_HUMAN 9MMPA P04049 138 630 648.0 AGS:60701 ATPlike Inactive DFGin 6.1073 13.2684 BLBplus -130.39, 177.17 56.68, 47.87 -99.84, 149.88 40.92, 87.91 73.17, -140.77 out-out out 14.3612 Saltbr-out 12.3822 HRD-out -74.8, 81.36 -67.74, 154.91 out-out-out SNCooo out-out ActLoopNT-out 9.1666 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -156.54, 146.13 APE9-dihe-na 117.78, -173.39 APE8-dihe-in -67.5, 146.42 APE8-rot-in 282.71 APE67-dihe-in -62.97, -41.04 -80.62, -35.94 APE12-dist-out 14.2949 APE11-dist-out 14.3656 APE10-dist-out 10.6756 APE9-dist-out 7.9092 Q156R,D587E SEP259,SEP621 SEP259,SEP621 EM 3.4 999.0 999.0 A 683.0 348.0 0 30 30 0 [[349, 608]] 1.0 9mmp TKL_RAF1_HUMAN TKL 2e-80 276.3 3.0 266.0 264.0 485 486 487 489 491 375 393 397 465 467 466 468.0 530 515 510 509 508 507 506 505 504 422 RAF proto-oncogene serine/threonine-protein kinase
TYR ABL1 ABL1_HUMAN 2G2FB P00519 234 502 1130.0 AGS:601 ATPlike Inactive DFGout 13.4774 11.5253 None -73.05, 151.22 -78.4, -31.56 -2.81, -74.15 167.03, 54.1 -90.78, 24.63 in-in in 8.8964 Saltbr-in 3.3728 HRD-out -112.09, 115.32 -73.34, -1.05 in-out-in SNCioi out-in ActLoopNT-out 5.759 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -84.67, 144.36 APE9-dihe-in -134.57, 156.36 APE8-dihe-in -59.22, 104.92 APE8-rot-na 31.18 APE67-dihe-in -59.35, -15.8 -52.01, -51.94 APE12-dist-na 18.8868 APE11-dist-na 14.2996 APE10-dist-na 17.6873 APE9-dist-in 6.8177 H396P None None XRAY 2.7 0.234 0.286 B 287.0 264.0 5 29 29 0 [[242, 495]] 1.0 2g2f TYR_ABL1_HUMAN TYR 6.9e-100 339.6 1.0 260.0 260.0 380 381 382 384 386 271 286 290 360 362 361 363.0 421 409 404 403 402 401 400 399 398 316 Tyrosine-protein kinase ABL1
TYR EPHA2 EPHA2_HUMAN 5I9VA P29317 605 896 976.0 AGS:1001 ATPlike None DFGin 5.7967 14.9205 BLAminus -141.81, -171.65 57.06, 75.11 -93.17, 20.3 299.55, 97.8 -61.14, -30.9 in-in in 8.6187 Saltbr-in 2.8216 HRD-in -77.85, -47.75 76.63, -12.15 in-in-none SNCiin in-none ActLoopNT-in 2.9177 ActLoopCT-none TYR APEdihe_niiai APEdist_aaai APE10-dihe-none 999.0, 136.3 APE9-dihe-in -111.36, 131.85 APE8-dihe-in -64.26, 123.12 APE8-rot-na 332.19 APE67-dihe-in -77.38, -2.66 -54.41, -44.48 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 10.7119 APE9-dist-in 5.3421 None None None XRAY 1.458 0.164 0.191 A 306.0 279.0 13 31 18 13 [[613, 873]] 1.0 5i9v TYR_EPHA2_HUMAN TYR 5.5e-108 366.1 2.0 261.0 260.0 756 757 758 760 762 646 663 667 736 738 737 739.0 799 787 782 781 780 779 778 777 776 693 Ephrin type-A receptor 2
TYR PTK2B FAK2_HUMAN 3FZPA Q14289 419 692 1009.0 AGS:999 ATPlike Inactive DFGout 13.1422 11.9545 None -76.23, -175.2 -102.86, 78.24 -127.89, 25.71 251.37, 121.91 162.92, 999.0 in-out in 9.4326 Saltbr-out 4.27 HRD-out -102.53, 130.12 -113.62, 20.17 out-none-in SNConi none-in ActLoopNT-none 999.0 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -45.5, 93.87 APE9-dihe-in -76.94, 158.38 APE8-dihe-in -82.03, 71.77 APE8-rot-na 28.7 APE67-dihe-in -73.32, -11.31 -53.21, -40.06 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-in 7.6516 None None None XRAY 2.1 0.212 0.239 A 277.0 259.0 15 29 14 15 [[425, 681]] 1.0 3fzp TYR_PTK2B_HUMAN TYR 2.4e-92 314.8 2.0 260.0 259.0 566 567 568 570 572 457 474 478 546 548 547 549.0 607 595 590 589 588 587 586 585 584 503 Protein-tyrosine kinase 2-beta
TYR TYK2-1 TYK2_HUMAN 5C03A P29597 579 869 1187.0 AGS:901 ATPlike Pseudo DFGin 7.3841 13.1047 None -83.93, 173.19 -65.21, 161.12 -79.17, -4.85 20.2, 153.73 66.68, -148.85 in-na in 9.7941 Saltbr-na 999.0 HRD-in -90.34, -65.69 85.25, 3.79 na-out-out SNCaoo out-out ActLoopNT-out 7.8327 ActLoopCT-out TYR APEdihe_oooao APEdist_aaao APE10-dihe-out -60.44, -38.84 APE9-dihe-out -63.06, -21.54 APE8-dihe-out -87.7, -1.06 APE8-rot-na 196.81 APE67-dihe-out -97.84, 8.94 -69.26, 133.75 APE12-dist-na 10.117 APE11-dist-na 12.2506 APE10-dist-na 16.4571 APE9-dist-out 11.202 None None None XRAY 1.9 0.183 0.218 A 342.0 260.0 31 24 24 0 [[589, 868], [897, 1171]] 2.0 5c03 TYR_TYK2-1_HUMAN TYR 7e-60 208.6 2.0 260.0 259.0 758 759 760 762 764 642 658 662 731 733 732 734.0 796 782 777 776 775 774 773 772 771 688 Non-receptor tyrosine-protein kinase TYK2
TYR TYK2-1 TYK2_HUMAN 5C03B P29597 580 870 1187.0 AGS:901 ATPlike Pseudo DFGin 7.5169 12.8858 None -71.74, 164.11 -66.43, 161.04 -81.86, 0.59 24.73, 148.49 67.14, -147.92 in-na in 9.7089 Saltbr-na 999.0 HRD-in -90.78, -63.58 88.98, 2.52 na-out-out SNCaoo out-out ActLoopNT-out 7.9567 ActLoopCT-out TYR APEdihe_oooao APEdist_aaao APE10-dihe-out -62.24, -42.55 APE9-dihe-out -56.38, -27.94 APE8-dihe-out -85.13, -4.16 APE8-rot-na 194.3 APE67-dihe-out -97.21, 10.32 -66.64, 134.88 APE12-dist-na 9.6347 APE11-dist-na 12.3036 APE10-dist-na 16.4844 APE9-dist-out 11.2214 None None None XRAY 1.9 0.183 0.218 B 342.0 260.0 31 24 24 0 [[589, 868], [897, 1171]] 2.0 5c03 TYR_TYK2-1_HUMAN TYR 7e-60 208.6 2.0 260.0 259.0 758 759 760 762 764 642 658 662 731 733 732 734.0 796 782 777 776 775 774 773 772 771 688 Non-receptor tyrosine-protein kinase TYK2

Ligand: AGS

Total number of chains: 78
Active chains: 9
Total number of genes: 25
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 26 33.3% 4Y12A
DFGin BLBplus 16 20.5% 9MMQA
DFGin BLBminus 10 12.8% 3OROA
None None 9 11.5% 3W8QA
DFGin None 8 10.3% 6Z4XB
DFGin ABAminus 6 7.7% 6TSZU
DFGout None 2 2.6% 2G2FB
DFGinter None 1 1.3% 2W5BA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

Group Gene SwissprotID PDB UniprotID First_obs_res Last_obs_res Length_Unp Ligand Ligand_type Activity_label Spatial_label Phe_Glu4_dis Phe_Lys_dis Dihedral_label XDFG
φ,ψ		 DFG-Asp
φ,ψ		 DFG-Phe
φ,ψ		 DFG-Phe
χ1,χ2		 DFG-Gly
φ,ψ		 ChelixSaltbr_label Chelix_label Lys_Glu_dis Saltbr_label LysNZ_GluOE_dis HRD_label His φ,ψ Arg φ,ψ SNC_label SNCpymol_label ActLoop_label ActLoopNT_label DFG6_XHRD_dis ActLoopCT_label APEtype APEdihe_label APEdist_label APE10_dihe_label APE10 φ,ψ APE9_dihe_label APE9 φ,ψ APE8_dihe_label APE8 φ,ψ APE8_rotamer_label APE8 χ1 APE67_label APE6 φ,ψ APE7 φ,ψ APE12_dist_label APE12_DFG4_dis APE11_dist_label APE11_DFG4_dis APE10_dist_label APE10_DFG4_dis APE9_dist_label APE9_Arg_dis Chain_mut Chain_phos Modified_aa Method Resolution Rvalue FreeRvalue Chain_id ChainLen Ordered_residues DomainBreak ActLoopLength ActLoopResolvedResidues ActLoopDisorderedResidues Kinase_domains_Unp N_Kinase_domains_Unp pdb Species Kincore_name hmm Evalue Score hmmbeg hmmend hmmlen XDFGnum DFGnum PHEnum DFG4num DFG6num LYSnum GLUnum GLU4num XHRDnum ARGnum HRDnum HRDaspnum aFaspnum APEnum APE6num APE7num APE8num APE9num APE10num APE11num APE12num Hinge1num Protein_name
CMGC CDK7 G0SFC6_CHATD 6Z4XB G0SFC6 78 399 437.0 AGS:501 ATPlike Inactive DFGin 6.0664 15.963 None -120.32, -64.48 -72.18, 111.3 -111.88, 18.28 274.56, 83.55 -65.42, -11.7 in-out in 8.9011 Saltbr-out 3.7194 HRD-in -82.6, -50.25 63.05, 25.15 out-in-in SNCoii in-in ActLoopNT-in 2.7476 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -143.45, 163.36 APE9-dihe-na 70.87, 128.98 APE8-dihe-in -54.32, 144.95 APE8-rot-in 303.7 APE67-dihe-in -58.5, -22.2 -48.9, -49.43 APE12-dist-in 13.1214 APE11-dist-in 10.3276 APE10-dist-in 6.1584 APE9-dist-in 3.0434 None None None XRAY 2.98 0.205 0.246 B 437.0 322.0 0 28 28 0 [[92, 383]] 1.0 6z4x Chaetomium thermophilum CMGC_CDK7_CHATD CMGC 1.5e-61 214.7 2.0 300.0 299.0 237 238 239 241 243 122 141 145 217 219 218 220.0 278 265 260 259 258 257 256 255 254 173 Protein kinase domain-containing protein
CMGC CDK7 G0SFC6_CHATD 6Z4XE G0SFC6 77 399 437.0 AGS:501 ATPlike Inactive DFGin 6.0452 15.8914 None -120.83, -65.38 -72.38, 111.16 -111.28, 19.39 275.38, 85.23 -65.84, -12.59 in-out in 8.9023 Saltbr-out 3.6666 HRD-in -79.74, -48.62 65.81, 23.05 out-in-in SNCoii in-in ActLoopNT-in 2.907 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -144.65, 161.76 APE9-dihe-na 74.19, 130.39 APE8-dihe-in -54.74, 142.95 APE8-rot-in 302.5 APE67-dihe-in -58.43, -23.34 -50.65, -48.02 APE12-dist-in 13.252 APE11-dist-in 10.4227 APE10-dist-in 6.1469 APE9-dist-in 3.1587 None None None XRAY 2.98 0.205 0.246 E 437.0 323.0 0 28 28 0 [[92, 383]] 1.0 6z4x Chaetomium thermophilum CMGC_CDK7_CHATD CMGC 1.5e-61 214.7 2.0 300.0 299.0 237 238 239 241 243 122 141 145 217 219 218 220.0 278 265 260 259 258 257 256 255 254 173 Protein kinase domain-containing protein
TYR SRC SRC_CHICK 3DQWA P00523 255 533 533.0 AGS:534 ATPlike Active DFGin 6.3569 14.1326 BLAminus -133.72, -176.8 56.69, 80.14 -98.42, 17.02 297.52, 87.02 -49.14, -41.19 in-in in 7.931 Saltbr-in 2.6874 HRD-in -86.31, -48.96 78.42, -4.92 in-in-in SNCiii in-in ActLoopNT-in 3.0136 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -125.37, 137.46 APE9-dihe-in -129.59, 150.85 APE8-dihe-in -68.35, 111.94 APE8-rot-na 22.98 APE67-dihe-in -63.37, -24.29 -54.33, -47.45 APE12-dist-na 14.4541 APE11-dist-na 9.9175 APE10-dist-na 12.7255 APE9-dist-in 6.8354 T338I PTR416 PTR416 XRAY 2.017 0.207 0.245 A 286.0 279.0 0 29 29 0 [[267, 518]] 1.0 3dqw Gallus gallus TYR_SRC_CHICK TYR 6.7e-94 319.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
TYR SRC SRC_CHICK 3DQWB P00523 255 533 533.0 AGS:534 ATPlike Active DFGin 6.515 14.1123 BLAminus -130.32, -179.28 59.57, 78.46 -98.37, 14.52 296.04, 88.38 -51.47, -39.24 in-in in 7.8608 Saltbr-in 2.5941 HRD-in -92.73, -49.37 74.2, -0.04 in-in-in SNCiii in-in ActLoopNT-in 2.9546 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -118.73, 138.44 APE9-dihe-in -131.19, 150.2 APE8-dihe-in -68.24, 113.76 APE8-rot-na 20.72 APE67-dihe-in -68.02, -21.16 -58.05, -42.12 APE12-dist-na 14.5771 APE11-dist-na 10.0679 APE10-dist-na 12.667 APE9-dist-in 6.8354 T338I PTR416 PTR416 XRAY 2.017 0.207 0.245 B 286.0 279.0 0 29 29 0 [[267, 518]] 1.0 3dqw Gallus gallus TYR_SRC_CHICK TYR 6.7e-94 319.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
TYR SRC SRC_CHICK 3DQWC P00523 258 533 533.0 AGS:534 ATPlike Active DFGin 7.2297 15.5864 BLAminus -138.39, -169.49 49.44, 64.48 -88.87, 22.55 279.28, 86.64 -59.44, -34.1 in-in in 7.6659 Saltbr-in 3.0464 HRD-in -87.18, -49.68 80.05, -15.46 in-in-in SNCiii in-in ActLoopNT-in 2.9359 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -114.69, 105.75 APE9-dihe-in -126.06, 131.23 APE8-dihe-in -49.28, 106.82 APE8-rot-na 333.72 APE67-dihe-in -71.67, -16.03 -52.29, -42.49 APE12-dist-na 14.0713 APE11-dist-na 9.8506 APE10-dist-na 10.9474 APE9-dist-in 6.1241 T338I PTR416 PTR416 XRAY 2.017 0.207 0.245 C 286.0 276.0 0 29 29 0 [[267, 518]] 1.0 3dqw Gallus gallus TYR_SRC_CHICK TYR 6.7e-94 319.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
TYR SRC SRC_CHICK 3DQWD P00523 257 533 533.0 AGS:534 ATPlike Active DFGin 7.1829 15.4998 BLAminus -135.25, -176.07 62.11, 64.12 -89.05, 15.75 281.43, 79.51 -51.86, -37.09 in-in in 7.529 Saltbr-in 3.0179 HRD-in -81.74, -56.17 86.4, -15.46 in-in-in SNCiii in-in ActLoopNT-in 2.9706 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -120.41, 149.47 APE9-dihe-in -128.09, 155.96 APE8-dihe-in -55.17, 98.07 APE8-rot-na 334.76 APE67-dihe-in -67.99, -16.44 -49.1, -40.45 APE12-dist-na 15.0709 APE11-dist-na 10.3048 APE10-dist-na 13.2932 APE9-dist-in 6.675 T338I PTR416 PTR416 XRAY 2.017 0.207 0.245 D 286.0 277.0 0 29 29 0 [[267, 518]] 1.0 3dqw Gallus gallus TYR_SRC_CHICK TYR 6.7e-94 319.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
AGC PKN2 PKN2_HUMAN 4CRSA Q16513 646 984 984.0 AGS:61985 ATPlike Inactive DFGin 6.1564 12.7634 BLAminus -120.55, 175.31 66.4, 80.82 -96.2, 27.19 310.22, 114.46 -62.58, -30.59 in-in in 9.266 Saltbr-in 2.7477 HRD-in -80.04, -60.18 72.41, -11.14 in-in-out SNCiio in-out ActLoopNT-in 2.9879 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -156.69, 159.24 APE9-dihe-na 123.16, -174.45 APE8-dihe-in -102.24, 141.6 APE8-rot-out 48.54 APE67-dihe-in -62.99, -37.09 -38.53, -44.47 APE12-dist-in 7.9841 APE11-dist-in 11.144 APE10-dist-in 5.8598 APE9-dist-in 4.1205 None SEP755,TPO816,TPO958 SEP755,TPO816,TPO958 XRAY 2.75 0.213 0.262 A 341.0 332.0 0 28 28 0 [[657, 916]] 1.0 4crs Homo sapiens AGC_PKN2_HUMAN AGC 1.2e-93 318.9 1.0 260.0 260.0 799 800 801 803 805 686 705 709 779 781 780 782.0 839 827 822 821 820 819 818 817 816 738 Serine/threonine-protein kinase N2
CAMK CHEK1 CHK1_HUMAN 7AKMA O14757 2 271 476.0 AGS:401 ATPlike Active DFGin 6.7746 14.1434 BLAminus -128.66, 150.55 71.15, 96.3 -103.32, 28.49 292.74, 82.8 -70.74, -21.81 in-in in 9.111 Saltbr-in 2.7059 HRD-in -78.28, -45.32 76.75, -0.14 in-in-in SNCiii in-in ActLoopNT-in 3.0115 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -163.43, 171.3 APE9-dihe-na 110.38, -147.97 APE8-dihe-in -135.73, 125.59 APE8-rot-in 300.71 APE67-dihe-in -62.97, -17.75 -56.42, -42.48 APE12-dist-in 9.3085 APE11-dist-in 11.6735 APE10-dist-in 6.1706 APE9-dist-in 3.4066 D10R None None XRAY 1.93 0.199 0.242 A 298.0 270.0 0 30 30 0 [[9, 265]] 1.0 7akm Homo sapiens CAMK_CHEK1_HUMAN CAMK 3.4e-71 245.5 2.0 256.0 255.0 147 148 149 151 153 38 55 59 127 129 128 130.0 190 177 172 171 170 169 168 167 166 85 Serine/threonine-protein kinase Chk1
CMGC CDK7 CDK7_HUMAN 6XBZJ P50613 10 312 346.0 AGS:402 ATPlike Inactive DFGin 6.5749 15.4027 ABAminus -82.2, -66.45 -124.23, 139.62 -119.21, 25.52 290.81, 70.1 -71.19, -16.45 in-out in 8.0 Saltbr-out 4.8 HRD-out -77.12, 93.04 -84.92, 20.14 out-in-in SNCoii in-in ActLoopNT-in 2.8045 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -98.95, 83.93 APE9-dihe-na -171.97, 152.98 APE8-dihe-in -55.47, 134.49 APE8-rot-in 286.18 APE67-dihe-in -62.05, -27.13 -54.66, -43.29 APE12-dist-in 13.3556 APE11-dist-in 11.0349 APE10-dist-in 6.0348 APE9-dist-in 3.3428 None SEP164 SEP164 EM 2.8 999.0 999.0 J 391.0 298.0 5 28 28 0 [[12, 295]] 1.0 6xbz Homo sapiens CMGC_CDK7_HUMAN CMGC 2.4e-78 271.1 1.0 301.0 301.0 154 155 156 158 160 41 62 66 134 136 135 137.0 195 182 177 176 175 174 173 172 171 92 Cyclin-dependent kinase 7
CMGC CDK7 CDK7_HUMAN 8P6YJ P50613 10 310 346.0 AGS:60401 ATPlike Inactive DFGin 6.8248 15.586 BLAminus -141.03, -177.14 58.28, 66.28 -86.35, 22.83 281.11, 73.93 -65.68, -18.8 in-out in 8.4298 Saltbr-out 4.9403 HRD-in -69.3, -48.75 64.3, 11.38 out-in-in SNCoii in-in ActLoopNT-in 2.7938 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -124.65, 164.79 APE9-dihe-na 67.53, 137.74 APE8-dihe-in -59.47, 143.7 APE8-rot-in 312.32 APE67-dihe-in -62.79, -23.75 -56.89, -39.97 APE12-dist-in 13.3135 APE11-dist-in 11.0418 APE10-dist-in 6.6455 APE9-dist-in 3.274 None None None EM 1.9 999.0 999.0 J 349.0 286.0 15 28 28 0 [[12, 295]] 1.0 8p6y Homo sapiens CMGC_CDK7_HUMAN CMGC 1.6e-78 271.7 1.0 301.0 301.0 154 155 156 158 160 41 62 66 134 136 135 137.0 195 182 177 176 175 174 173 172 171 92 Cyclin-dependent kinase 7
CMGC CDK7 CDK7_HUMAN 9HIYJ P50613 10 310 346.0 AGS:60401 ATPlike Active DFGin 6.7269 15.7177 BLAminus -144.39, -174.23 58.17, 64.72 -87.83, 23.91 281.92, 72.77 -77.85, -11.75 in-in in 8.5421 Saltbr-in 3.5 HRD-in -67.31, -50.64 65.74, 8.28 in-in-in SNCiii in-in ActLoopNT-in 2.7332 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -132.25, 164.09 APE9-dihe-na 67.64, 142.62 APE8-dihe-in -59.57, 146.87 APE8-rot-in 317.63 APE67-dihe-in -64.96, -18.05 -61.86, -38.17 APE12-dist-in 13.5793 APE11-dist-in 11.3215 APE10-dist-in 6.933 APE9-dist-in 3.3515 D97N None None EM 2.3 999.0 999.0 J 349.0 287.0 14 28 25 3 [[12, 295]] 1.0 9hiy Homo sapiens CMGC_CDK7_HUMAN CMGC 1.8e-78 271.6 1.0 301.0 301.0 154 155 156 158 160 41 62 66 134 136 135 137.0 195 182 177 176 175 174 173 172 171 92 Cyclin-dependent kinase 7
NEK NEK2 NEK2_HUMAN 2W5BA P51955 3 271 445.0 AGS:61280 ATPlike Inactive DFGinter 8.5035 5.6928 None -133.84, 63.71 -87.34, 106.84 -95.06, 50.42 207.49, 72.2 -49.75, -30.44 out-out out 12.5887 Saltbr-out 12.7626 HRD-out -82.64, 121.7 -138.12, 47.77 out-out-out SNCooo out-out ActLoopNT-out 12.438 ActLoopCT-out nonTYR APEdihe_aaiio APEdist_oooo APE10-dihe-na -74.41, -42.54 APE9-dihe-na -62.33, 153.14 APE8-dihe-in -108.21, 120.03 APE8-rot-in 313.31 APE67-dihe-out -53.46, -34.47 -75.96, 66.07 APE12-dist-out 14.0599 APE11-dist-out 18.7846 APE10-dist-out 19.3977 APE9-dist-out 15.8788 T175A None None XRAY 2.4 0.186 0.245 A 279.0 263.0 6 28 28 0 [[8, 271]] 1.0 2w5b Homo sapiens NEK_NEK2_HUMAN NEK 3.4e-109 370.2 1.0 256.0 256.0 158 159 160 162 164 37 55 59 138 140 139 141.0 198 186 181 180 179 178 177 176 175 87 Serine/threonine-protein kinase Nek2
OTHER TLK2 TLK2_HUMAN 5O0YA Q86UE8 456 743 772.0 AGS:801 ATPlike Inactive DFGin 5.8382 16.6964 BLAminus -154.54, -173.82 64.72, 68.79 -84.13, 30.07 299.95, 83.25 -66.33, -38.04 out-out out 11.511 Saltbr-out 5.9716 HRD-out -83.23, 94.84 -74.56, -13.23 out-in-in SNCoii in-in ActLoopNT-in 2.8579 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -69.76, 159.55 APE9-dihe-na 89.86, 175.53 APE8-dihe-in -96.42, 113.01 APE8-rot-in 322.47 APE67-dihe-in -58.01, -37.07 -65.88, -24.96 APE12-dist-in 12.0821 APE11-dist-in 11.0119 APE10-dist-in 6.4189 APE9-dist-in 5.7404 None None None XRAY 2.86 0.184 0.21 A 579.0 288.0 0 35 35 0 [[462, 741]] 1.0 5o0y Homo sapiens OTHER_TLK2_HUMAN CAMK 6.6e-54 190.4 1.0 256.0 256.0 612 613 614 616 618 491 514 518 589 591 590 592.0 663 647 642 641 640 639 638 637 636 545 Serine/threonine-protein kinase tousled-like 2
OTHER ULK4 ULK4_HUMAN 6TSZU Q96C45 2 285 1275.0 AGS:60301 ATPlike Pseudo DFGin 6.3704 18.2708 ABAminus -125.81, 9.4 -156.01, 117.6 -115.95, 19.15 288.81, 81.65 -56.0, -43.19 out-na out 14.2882 Saltbr-na 999.0 HRD-in -78.74, -35.33 74.51, -30.17 na-in-out SNCaio in-out ActLoopNT-in 2.7475 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -74.27, 133.36 APE9-dihe-na -108.57, -165.46 APE8-dihe-in -71.23, 118.04 APE8-rot-in 324.52 APE67-dihe-in -65.15, -30.07 -62.89, -23.31 APE12-dist-in 8.5787 APE11-dist-out 6.171 APE10-dist-out 9.1817 APE9-dist-in 5.697 None None None XRAY 1.9 0.203 0.253 U 305.0 283.0 1 51 50 1 [[4, 280]] 1.0 6tsz Homo sapiens OTHER_ULK4_HUMAN ULK 1.2e-118 401.1 1.0 256.0 256.0 138 139 140 142 144 34 46 50 118 120 119 121.0 201 189 184 183 182 181 180 179 178 76 Serine/threonine-protein kinase ULK4
STE MAP2K1 MP2K1_HUMAN 3EQDA Q02750 39 382 393.0 AGS:2 ATPlike Inactive DFGin 5.9616 14.1078 BLBplus -148.22, 169.15 61.13, 42.77 -94.74, 116.91 42.1, 90.93 -43.97, 123.65 out-out out 15.0819 Saltbr-out 14.8735 HRD-in -61.74, -59.42 83.27, -18.79 out-out-out SNCooo out-out ActLoopNT-out 10.9097 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oooo APE10-dihe-na -139.36, 111.64 APE9-dihe-na -74.03, 166.79 APE8-dihe-in -61.05, 144.18 APE8-rot-out 194.8 APE67-dihe-in -63.95, -10.98 -107.09, 3.75 APE12-dist-out 19.9512 APE11-dist-out 15.017 APE10-dist-out 16.7322 APE9-dist-out 9.444 S298N,S299K,Y300F None None XRAY 2.1 0.211 999.0 A 360.0 315.0 29 26 26 0 [[68, 361]] 1.0 3eqd Homo sapiens STE_MAP2K1_HUMAN STE 1.8e-97 331.7 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 8DGSB Q02750 38 383 393.0 AGS:60801,LCJ:60803 ATPlike,Type1 Inactive DFGin 6.249 12.9971 BLBplus -155.73, -179.02 61.68, 27.26 -72.39, 155.67 44.5, 85.53 -87.2, 64.42 out-out out 16.2947 Saltbr-out 16.06 HRD-in -62.57, -46.0 64.99, -4.53 out-out-out SNCooo out-out ActLoopNT-out 8.7094 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -122.25, 153.26 APE9-dihe-na -110.07, 177.24 APE8-dihe-out -99.46, -47.43 APE8-rot-out 69.24 APE67-dihe-out -133.48, 170.62 -132.77, 150.72 APE12-dist-out 17.1114 APE11-dist-out 20.5769 APE10-dist-out 22.9193 APE9-dist-out 13.2707 S218A,S222A None None EM 4.3 999.0 999.0 B 414.0 314.0 32 26 26 0 [[68, 361]] 1.0 8dgs Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 8DGTB Q02750 43 385 393.0 AGS:60402,LCJ:60403 ATPlike,Type3 Inactive DFGin 5.9682 13.5357 BLBplus -152.99, 179.37 55.42, 45.61 -100.12, 157.06 44.99, 96.32 -80.94, 77.56 out-out out 15.5691 Saltbr-out 15.7331 HRD-in -64.15, -51.45 68.84, -11.98 out-out-out SNCooo out-out ActLoopNT-out 8.9452 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -67.75, 131.31 APE9-dihe-na -82.42, -172.83 APE8-dihe-out -101.84, -12.18 APE8-rot-out 77.74 APE67-dihe-out -124.11, 144.61 -162.74, 152.77 APE12-dist-out 16.6735 APE11-dist-out 21.6272 APE10-dist-out 23.2855 APE9-dist-out 13.7054 S218A,S222A None None EM 3.9 999.0 999.0 B 414.0 311.0 32 26 26 0 [[68, 361]] 1.0 8dgt Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 9MMPB Q02750 62 380 393.0 AGS:60701,LCJ:60702 ATPlike,Type3 Inactive DFGin 6.4937 13.7015 BLBplus -142.17, 163.3 59.56, 65.37 -113.14, 157.69 39.56, 95.33 -79.99, 73.26 out-out out 15.7564 Saltbr-out 16.3325 HRD-in -69.63, -60.91 71.6, -9.27 out-out-out SNCooo out-out ActLoopNT-out 8.0011 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na -73.57, 130.1 APE9-dihe-na -94.62, 178.33 APE8-dihe-out -96.1, -46.02 APE8-rot-in 278.39 APE67-dihe-out -136.63, 147.99 -117.77, 157.18 APE12-dist-out 17.2275 APE11-dist-out 22.2405 APE10-dist-out 24.3959 APE9-dist-out 13.7692 S218A,S222A None None EM 3.4 999.0 999.0 B 415.0 279.0 40 26 26 0 [[68, 361]] 1.0 9mmp Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 9MMQB Q02750 62 380 393.0 AGS:701,LCJ:703 ATPlike,Type3 Inactive DFGin 6.6749 13.4889 BLBplus -138.6, 170.41 60.57, 44.79 -97.28, 158.99 35.24, 93.11 -75.64, 83.14 out-out out 15.4214 Saltbr-out 15.6346 HRD-in -61.2, -52.92 69.79, -9.3 out-out-out SNCooo out-out ActLoopNT-out 9.0103 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na -65.78, 148.58 APE9-dihe-na -99.52, -176.8 APE8-dihe-out -104.42, -44.51 APE8-rot-in 299.56 APE67-dihe-out -150.89, 153.99 -135.56, 174.2 APE12-dist-out 17.2664 APE11-dist-out 22.0929 APE10-dist-out 24.0771 APE9-dist-out 13.54 S218A,S222A None None EM 2.9 999.0 999.0 B 415.0 279.0 40 26 26 0 [[68, 361]] 1.0 9mmq Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 9MMRB Q02750 62 380 393.0 AGS:60701,LCJ:60703 ATPlike,Type3 Inactive DFGin 6.847 13.5448 BLBplus -144.47, 166.22 62.86, 45.64 -102.79, 155.22 38.56, 95.23 -78.03, 72.6 out-out out 15.3255 Saltbr-out 15.7338 HRD-in -59.38, -50.94 68.52, -2.49 out-out-out SNCooo out-out ActLoopNT-out 8.9519 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na -61.82, 155.36 APE9-dihe-na -107.83, -179.82 APE8-dihe-out -105.89, -53.41 APE8-rot-in 308.85 APE67-dihe-out -136.82, 148.35 -127.86, 156.49 APE12-dist-out 17.0348 APE11-dist-out 22.0064 APE10-dist-out 24.0306 APE9-dist-out 13.5803 S218A,S222A None None EM 3.9 999.0 999.0 B 415.0 279.0 40 26 26 0 [[68, 361]] 1.0 9mmr Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 9MMSB Q02750 63 380 393.0 AGS:701,LCJ:703 ATPlike,Type3 Inactive DFGin 6.8547 13.563 BLBplus -141.52, 164.23 63.42, 46.21 -99.5, 165.31 34.19, 90.42 -80.53, 73.26 out-out out 15.4077 Saltbr-out 15.7694 HRD-in -66.2, -52.71 70.98, -11.79 out-out-out SNCooo out-out ActLoopNT-out 8.8575 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na -63.41, 150.0 APE9-dihe-na -102.92, -178.46 APE8-dihe-out -108.1, -35.69 APE8-rot-in 324.75 APE67-dihe-out -152.78, 143.47 -133.76, 175.52 APE12-dist-out 17.2823 APE11-dist-out 22.2166 APE10-dist-out 24.3527 APE9-dist-out 13.6751 S218A,S222A None None EM 3.3 999.0 999.0 B 415.0 278.0 40 26 26 0 [[68, 361]] 1.0 9mms Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 3EQCA Q02750 39 382 393.0 3BM:1,AGS:2 Type3,ATPlike Inactive DFGin 6.1057 13.8617 BLBplus -138.12, -177.12 54.65, 30.92 -83.74, 156.51 44.84, 87.16 -79.52, 70.22 out-out out 15.3111 Saltbr-out 14.7046 HRD-in -64.92, -56.9 85.6, -17.06 out-out-out SNCooo out-out ActLoopNT-out 9.3671 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnoo APE10-dihe-na 999.0, 106.4 APE9-dihe-na -87.03, 145.5 APE8-dihe-in -52.92, 140.89 APE8-rot-out 198.88 APE67-dihe-in -66.8, -13.13 -101.4, 5.04 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 19.4624 APE9-dist-out 9.4427 S298N,S299K,Y300F None None XRAY 1.8 0.201 0.235 A 360.0 312.0 32 26 23 3 [[68, 361]] 1.0 3eqc Homo sapiens STE_MAP2K1_HUMAN STE 1.8e-97 331.7 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 3W8QA Q02750 39 382 393.0 AGS:401 ATPlike Inactive None 13.1078 15.1223 None -61.95, 160.72 -84.08, 71.5 -96.94, 162.22 62.16, 97.76 71.69, 28.05 out-out out 16.278 Saltbr-out 14.58 HRD-out -76.9, 112.47 -115.43, 103.34 out-out-out SNCooo out-out ActLoopNT-out 11.4785 ActLoopCT-out nonTYR APEdihe_aaioo APEdist_oooo APE10-dihe-na -85.42, 139.56 APE9-dihe-na 64.92, 170.12 APE8-dihe-in -109.26, 128.33 APE8-rot-out 42.71 APE67-dihe-out -157.09, 132.41 -146.54, 166.67 APE12-dist-out 15.6567 APE11-dist-out 20.9119 APE10-dist-out 24.1063 APE9-dist-out 32.1107 T292A,S298A None None XRAY 2.2 0.201 0.268 A 350.0 318.0 26 26 26 0 [[68, 361]] 1.0 3w8q Homo sapiens STE_MAP2K1_HUMAN STE 1.6e-97 331.8 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6Q0TC Q02750 43 379 393.0 LCJ:60402,AGS:60403 Type1,ATPlike Inactive None 999.0 999.0 None -140.61, 176.69 54.64, 28.33 -81.67, 161.61 999.0, 999.0 -81.74, 73.01 out-none out 15.4983 Saltbr-none 999.0 HRD-in -63.91, -56.51 90.24, -35.06 none-out-out SNCnoo out-out ActLoopNT-out 9.2901 ActLoopCT-out nonTYR APEdihe_aaono APEdist_oooo APE10-dihe-na -73.68, 137.65 APE9-dihe-na -84.71, 179.02 APE8-dihe-out -112.93, -24.43 APE8-rot-none 999.0 APE67-dihe-out -153.47, 146.62 -142.35, -172.44 APE12-dist-out 17.1555 APE11-dist-out 21.6524 APE10-dist-out 23.7974 APE9-dist-out 13.4988 S218A,S222A None None EM 5.7 999.0 999.0 C 414.0 306.0 31 26 26 0 [[68, 361]] 1.0 6q0t Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6Q0JC Q02750 43 379 393.0 LCJ:60402,AGS:60403 Type1,ATPlike Inactive None 999.0 999.0 None -140.59, 176.71 54.64, 28.27 -81.59, 161.59 999.0, 999.0 -81.72, 72.97 out-none out 15.4979 Saltbr-none 999.0 HRD-in -63.96, -56.51 90.23, -35.02 none-out-out SNCnoo out-out ActLoopNT-out 9.2895 ActLoopCT-out nonTYR APEdihe_aaono APEdist_oooo APE10-dihe-na -73.68, 137.68 APE9-dihe-na -84.7, 179.01 APE8-dihe-out -112.95, -24.41 APE8-rot-none 999.0 APE67-dihe-out -153.48, 146.63 -142.35, -172.44 APE12-dist-out 17.1558 APE11-dist-out 21.6526 APE10-dist-out 23.7977 APE9-dist-out 13.4984 S218A,S222A None None EM 4.9 999.0 999.0 C 415.0 306.0 31 26 26 0 [[68, 361]] 1.0 6q0j Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6Q0JD Q02750 43 379 393.0 LCJ:60402,AGS:60403 Type1,ATPlike Inactive None 999.0 999.0 None -140.57, 176.69 54.62, 28.33 -81.6, 161.59 999.0, 999.0 -81.66, 72.9 out-none out 15.4977 Saltbr-none 999.0 HRD-in -63.9, -56.54 90.23, -35.02 none-out-out SNCnoo out-out ActLoopNT-out 9.2893 ActLoopCT-out nonTYR APEdihe_aaono APEdist_oooo APE10-dihe-na -73.75, 137.67 APE9-dihe-na -84.68, 179.02 APE8-dihe-out -112.95, -24.44 APE8-rot-none 999.0 APE67-dihe-out -153.47, 146.64 -142.36, -172.48 APE12-dist-out 17.1558 APE11-dist-out 21.6536 APE10-dist-out 23.7977 APE9-dist-out 13.4991 S218A,S222A None None EM 4.9 999.0 999.0 D 415.0 306.0 31 26 26 0 [[68, 361]] 1.0 6q0j Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1.0 257.0 257.0 207 208 209 211 213 97 114 118 187 189 188 190.0 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP3K14 M3K14_HUMAN 4DN5A Q99558 332 675 947.0 AGS:1008 ATPlike Inactive DFGin 5.2878 13.1112 BLAminus -131.59, 179.35 60.95, 82.45 -103.29, 32.07 306.31, 92.27 -67.11, -18.8 in-in in 8.6853 Saltbr-in 2.9369 HRD-in -77.9, -57.1 103.31, -30.91 in-in-out SNCiio in-out ActLoopNT-in 2.9712 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_noii APE10-dihe-na -78.44, 154.35 APE9-dihe-na -81.04, -47.74 APE8-dihe-in -132.59, 129.65 APE8-rot-in 312.19 APE67-dihe-in -58.65, -18.81 -60.26, -49.52 APE12-dist-none 999.0 APE11-dist-out 6.5883 APE10-dist-in 7.8559 APE9-dist-in 4.0634 S549D None None XRAY 2.5 0.184 0.222 A 356.0 331.0 13 33 20 13 [[399, 652]] 1.0 4dn5 Homo sapiens STE_MAP3K14_HUMAN STE 1.2e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 4DN5B Q99558 333 675 947.0 AGS:1003 ATPlike Inactive DFGin 5.1759 13.4557 BLAminus -145.78, -179.59 62.32, 78.55 -101.18, 33.37 302.78, 88.88 -68.82, -20.54 in-in in 8.7257 Saltbr-in 2.793 HRD-in -71.67, -53.16 96.85, -25.39 in-in-out SNCiio in-out ActLoopNT-in 3.0601 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_noii APE10-dihe-na -71.53, 164.6 APE9-dihe-na -90.39, -50.68 APE8-dihe-in -119.09, 127.96 APE8-rot-in 316.48 APE67-dihe-in -61.89, -23.89 -60.44, -46.4 APE12-dist-none 999.0 APE11-dist-out 7.2725 APE10-dist-in 7.9015 APE9-dist-in 4.3975 S549D None None XRAY 2.5 0.184 0.222 B 356.0 330.0 13 33 20 13 [[399, 652]] 1.0 4dn5 Homo sapiens STE_MAP3K14_HUMAN STE 1.2e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 8YHWA Q99558 334 675 947.0 AGS:701 ATPlike Inactive DFGin 5.2236 13.5714 BLAminus -131.51, 179.88 71.5, 78.13 -98.25, 28.21 291.83, 89.59 -66.77, -22.24 in-in in 8.7223 Saltbr-in 2.7921 HRD-in -71.07, -53.99 98.86, -11.92 in-in-out SNCiio in-out ActLoopNT-in 3.0735 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -75.92, 156.14 APE9-dihe-na -80.02, -42.5 APE8-dihe-in -134.73, 129.92 APE8-rot-in 297.24 APE67-dihe-in -59.65, -28.29 -63.54, -48.42 APE12-dist-in 7.9565 APE11-dist-out 7.1447 APE10-dist-in 7.9576 APE9-dist-in 3.9323 None None None XRAY 2.9 0.196 0.241 A 351.0 336.0 6 33 27 6 [[399, 652]] 1.0 8yhw Homo sapiens STE_MAP3K14_HUMAN STE 1.1e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 8YHWB Q99558 334 675 947.0 AGS:701 ATPlike Inactive DFGin 5.1974 13.554 BLAminus -130.79, 179.54 70.72, 77.54 -98.72, 28.4 292.26, 88.42 -69.38, -19.05 in-in in 8.709 Saltbr-in 2.7911 HRD-in -71.33, -54.32 99.41, -13.31 in-in-out SNCiio in-out ActLoopNT-in 3.0664 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -76.24, 156.09 APE9-dihe-na -79.79, -42.6 APE8-dihe-in -135.45, 130.6 APE8-rot-in 297.54 APE67-dihe-in -59.47, -28.17 -62.63, -49.6 APE12-dist-in 7.9156 APE11-dist-out 7.1095 APE10-dist-in 7.9837 APE9-dist-in 3.9653 None None None XRAY 2.9 0.196 0.241 B 351.0 335.0 7 33 26 7 [[399, 652]] 1.0 8yhw Homo sapiens STE_MAP3K14_HUMAN STE 1.1e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 8YHWC Q99558 334 675 947.0 AGS:701 ATPlike Inactive DFGin 5.2254 13.4003 BLAminus -132.02, 179.38 71.36, 77.79 -98.56, 28.33 292.74, 88.36 -67.25, -21.3 in-in in 8.6175 Saltbr-in 2.7835 HRD-in -71.64, -54.39 97.78, -10.79 in-in-out SNCiio in-out ActLoopNT-in 3.0563 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -76.71, 156.45 APE9-dihe-na -80.42, -42.16 APE8-dihe-in -135.43, 129.92 APE8-rot-in 298.13 APE67-dihe-in -59.95, -27.85 -61.25, -50.21 APE12-dist-in 7.8829 APE11-dist-out 7.1158 APE10-dist-in 7.9268 APE9-dist-in 3.9552 None None None XRAY 2.9 0.196 0.241 C 351.0 335.0 7 33 26 7 [[399, 652]] 1.0 8yhw Homo sapiens STE_MAP3K14_HUMAN STE 1.1e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 8YHWD Q99558 334 675 947.0 AGS:701,PE8:703 ATPlike,Allosteric Inactive DFGin 5.2071 13.52 BLAminus -132.04, 179.74 71.06, 78.01 -98.25, 28.04 291.93, 89.49 -68.38, -20.37 in-in in 8.7112 Saltbr-in 2.7954 HRD-in -71.1, -54.2 99.37, -12.6 in-in-out SNCiio in-out ActLoopNT-in 3.0757 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_ioii APE10-dihe-na -75.74, 155.59 APE9-dihe-na -80.11, -42.03 APE8-dihe-in -135.61, 130.31 APE8-rot-in 298.0 APE67-dihe-in -60.15, -27.6 -63.0, -48.69 APE12-dist-in 7.8856 APE11-dist-out 7.0875 APE10-dist-in 7.9923 APE9-dist-in 3.9502 None None None XRAY 2.9 0.196 0.241 D 351.0 329.0 13 33 20 13 [[399, 652]] 1.0 8yhw Homo sapiens STE_MAP3K14_HUMAN STE 1.1e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
TKL BRAF BRAF_HUMAN 6NYBA P15056 233 738 766.0 AGS:60801 ATPlike Inactive DFGin 5.4979 13.825 BLBplus -130.99, 171.98 57.42, 47.58 -103.38, 154.64 56.0, 92.93 63.13, -128.72 out-out out 13.8238 Saltbr-out 12.6037 HRD-in -73.31, -44.18 67.31, 1.32 out-out-out SNCooo out-out ActLoopNT-out 9.0654 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oooo APE10-dihe-na -162.22, 166.73 APE9-dihe-na 98.18, -110.24 APE8-dihe-in -136.25, 146.51 APE8-rot-out 61.57 APE67-dihe-in -62.67, -27.04 -119.01, -4.59 APE12-dist-out 14.6597 APE11-dist-out 15.6406 APE10-dist-out 13.8824 APE9-dist-out 8.7627 None SEP365,SEP729 SEP365,SEP729 EM 4.1 999.0 999.0 A 805.0 350.0 0 30 30 0 [[457, 716]] 1.0 6nyb Homo sapiens TKL_BRAF_HUMAN TKL 1.4e-80 277.0 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL BRAF BRAF_HUMAN 8DGSA P15056 155 738 766.0 AGS:60801 ATPlike Inactive DFGin 6.6063 13.2375 BLBplus -138.09, -166.17 58.48, 64.88 -134.87, 173.46 48.16, 90.78 58.1, -132.32 out-out out 14.5219 Saltbr-out 12.2584 HRD-in -71.36, -47.09 71.02, -12.92 out-out-out SNCooo out-out ActLoopNT-out 9.5544 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -160.2, 161.72 APE9-dihe-na 103.44, -137.95 APE8-dihe-in -102.25, 169.61 APE8-rot-in 312.72 APE67-dihe-in -64.56, -41.44 -121.48, -15.09 APE12-dist-out 14.0817 APE11-dist-out 15.8432 APE10-dist-out 12.4597 APE9-dist-out 8.209 None SEP365,SEP729 SEP365,SEP729 EM 4.3 999.0 999.0 A 805.0 427.0 0 30 30 0 [[457, 716]] 1.0 8dgs Homo sapiens TKL_BRAF_HUMAN TKL 1.4e-80 277.0 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL BRAF BRAF_HUMAN 8DGTA P15056 151 738 766.0 AGS:60801 ATPlike Inactive DFGin 5.641 13.6752 BLBplus -132.23, 178.7 56.78, 46.46 -100.79, 153.62 51.93, 96.21 64.7, -132.47 out-out out 13.9231 Saltbr-out 12.693 HRD-in -71.52, -43.55 65.96, -9.54 out-out-out SNCooo out-out ActLoopNT-out 8.9984 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oooo APE10-dihe-na -155.42, 128.83 APE9-dihe-na 147.85, 157.58 APE8-dihe-in -55.44, 116.98 APE8-rot-out 39.4 APE67-dihe-in -65.02, -24.91 -67.41, -12.47 APE12-dist-out 14.3676 APE11-dist-out 14.5426 APE10-dist-out 11.9345 APE9-dist-out 6.4575 None SEP365,SEP729 SEP365,SEP729 EM 3.9 999.0 999.0 A 805.0 431.0 0 30 30 0 [[457, 716]] 1.0 8dgt Homo sapiens TKL_BRAF_HUMAN TKL 1.4e-80 277.0 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL BRAF BRAF_HUMAN 8VYPC P15056 363 733 766.0 AGS:801 ATPlike Inactive None 999.0 999.0 None 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 in-out in 8.9984 Saltbr-out 6.5941 HRD-in -95.64, -57.28 53.13, 41.02 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none 999.0, 999.0 999.0, 999.0 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 V600E SEP365,SEP729 SEP365,SEP729 EM 3.29 999.0 999.0 C 767.0 171.0 110 30 0 30 [[457, 716]] 1.0 8vyp Homo sapiens TKL_BRAF_HUMAN TKL 1.3e-80 277.0 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL IRAK3 IRAK3_HUMAN 6ZIWI Q9Y616 153 451 596.0 AGS:501 ATPlike Pseudo DFGin 7.0579 15.4303 BLAminus -137.94, 171.27 73.33, 92.98 -113.57, 22.08 299.33, 103.06 -63.05, -21.88 in-out in 8.7771 Saltbr-out 6.0762 HRD-in -68.03, -51.72 91.9, -24.04 out-in-none SNCoin in-none ActLoopNT-in 2.6374 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -65.65, -29.02 999.0, 37.66 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None XRAY 2.18 0.218 0.25 I 316.0 267.0 32 34 15 19 [[164, 445]] 1.0 6ziw Homo sapiens TKL_IRAK3_HUMAN TKL 2.1e-70 243.3 4.0 266.0 263.0 310 311 312 314 316 192 212 216 290 292 291 293.0 356 344 339 338 337 336 335 334 333 242 Interleukin-1 receptor-associated kinase 3
TKL LIMK1 LIMK1_HUMAN 5L6WL P53667 330 633 647.0 AGS:60701 ATPlike Active DFGin 6.2348 14.3373 BLAminus -131.64, -166.52 46.75, 81.93 -92.83, 15.71 304.28, 98.92 -42.69, -49.84 in-in in 7.6644 Saltbr-in 2.6698 HRD-in -78.67, -47.86 69.62, -13.12 in-in-in SNCiii in-in ActLoopNT-in 3.0656 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -134.6, 165.2 APE9-dihe-na 100.19, 162.86 APE8-dihe-in -63.5, 131.5 APE8-rot-na 185.1 APE67-dihe-in -61.44, -31.47 -69.46, -29.71 APE12-dist-in 9.1162 APE11-dist-in 11.1338 APE10-dist-in 5.4376 APE9-dist-in 3.7616 None None None XRAY 2.53 0.229 0.284 L 310.0 288.0 16 42 26 16 [[339, 606]] 1.0 5l6w Homo sapiens TKL_LIMK1_HUMAN TKL 4.5e-77 265.1 3.0 266.0 264.0 477 478 479 481 483 368 384 388 457 459 458 460.0 531 519 514 513 512 511 510 509 508 414 LIM domain kinase 1
TKL MAP3K21 M3K21_HUMAN 4UYAA Q5TCX8 115 437 1036.0 AGS:1438 ATPlike Inactive DFGin 6.4628 13.9984 BLBplus -133.24, 174.99 55.83, 68.25 -140.94, 164.55 55.9, 82.39 72.5, 999.0 in-none in 9.8853 Saltbr-none 999.0 HRD-in -81.83, -51.37 74.29, 7.17 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aanni APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, -67.17 APE8-rot-none 999.0 APE67-dihe-in -51.82, -45.19 -73.69, -16.84 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 A214G,S303A,T307A None None XRAY 2.8 0.204 0.261 A 340.0 274.0 29 26 11 15 [[124, 400]] 1.0 4uya Homo sapiens TKL_MAP3K21_HUMAN TKL 1.2e-89 306.3 1.0 266.0 266.0 288 289 290 292 294 151 171 175 260 262 261 263.0 326 314 309 308 307 306 305 304 303 201 Mitogen-activated protein kinase kinase kinase 21
TKL RAF1 RAF1_HUMAN 9MMRA P04049 343 625 648.0 AGS:60701 ATPlike Inactive DFGin 5.4464 13.6261 BLBplus -135.09, 172.16 58.87, 36.16 -92.53, 159.81 52.16, 102.21 63.65, -134.37 out-out out 13.8632 Saltbr-out 12.3622 HRD-out -74.45, 80.03 -68.85, 163.44 out-out-out SNCooo out-out ActLoopNT-out 8.7183 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -153.07, 160.07 APE9-dihe-na 91.95, -174.93 APE8-dihe-in -63.61, 140.51 APE8-rot-in 299.95 APE67-dihe-in -59.35, -38.77 -86.72, -25.37 APE12-dist-out 15.0543 APE11-dist-out 14.7515 APE10-dist-out 11.0339 APE9-dist-out 8.4046 Q156R,Y340D,Y341D,D587E SEP621 SEP621 EM 3.9 999.0 999.0 A 681.0 283.0 0 30 30 0 [[349, 608]] 1.0 9mmr Homo sapiens TKL_RAF1_HUMAN TKL 2e-80 276.3 3.0 266.0 264.0 485 486 487 489 491 375 393 397 465 467 466 468.0 530 515 510 509 508 507 506 505 504 422 RAF proto-oncogene serine/threonine-protein kinase
TKL RAF1 RAF1_HUMAN 9MMSA P04049 343 610 648.0 AGS:701 ATPlike Inactive DFGin 6.0432 13.4123 BLBplus -130.72, 176.22 57.09, 37.64 -95.88, 150.42 38.9, 90.55 70.15, -138.14 out-out out 13.239 Saltbr-out 11.9633 HRD-out -75.89, 77.72 -68.75, 167.65 out-out-out SNCooo out-out ActLoopNT-out 9.0132 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -153.3, 137.93 APE9-dihe-na 117.05, 178.36 APE8-dihe-in -66.7, 143.78 APE8-rot-in 289.18 APE67-dihe-in -66.49, -26.11 -89.17, -21.29 APE12-dist-out 15.1652 APE11-dist-out 14.8651 APE10-dist-out 10.7824 APE9-dist-out 8.09 Q156R,Y340D,Y341D,D587E None None EM 3.3 999.0 999.0 A 681.0 268.0 0 30 30 0 [[349, 608]] 1.0 9mms Homo sapiens TKL_RAF1_HUMAN TKL 2e-80 276.3 3.0 266.0 264.0 485 486 487 489 491 375 393 397 465 467 466 468.0 530 515 510 509 508 507 506 505 504 422 RAF proto-oncogene serine/threonine-protein kinase
TKL RAF1 RAF1_HUMAN 9MMQA P04049 341 612 648.0 AGS:701 ATPlike Inactive DFGin 6.0418 13.4878 BLBplus -128.47, 173.58 60.41, 41.33 -95.4, 154.76 40.5, 88.25 68.22, -137.22 out-out out 13.7306 Saltbr-out 12.7147 HRD-out -73.84, 78.36 -65.55, 163.21 out-out-out SNCooo out-out ActLoopNT-out 9.1331 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -154.13, 160.3 APE9-dihe-na 98.38, -176.64 APE8-dihe-in -67.06, 138.58 APE8-rot-in 288.86 APE67-dihe-in -64.64, -31.65 -87.38, -18.69 APE12-dist-out 15.1677 APE11-dist-out 14.4229 APE10-dist-out 10.8266 APE9-dist-out 8.1068 Q156R,D587E None None EM 2.9 999.0 999.0 A 681.0 272.0 0 30 30 0 [[349, 608]] 1.0 9mmq Homo sapiens TKL_RAF1_HUMAN TKL 2e-80 276.3 3.0 266.0 264.0 485 486 487 489 491 375 393 397 465 467 466 468.0 530 515 510 509 508 507 506 505 504 422 RAF proto-oncogene serine/threonine-protein kinase
TKL RAF1 RAF1_HUMAN 9MMPA P04049 138 630 648.0 AGS:60701 ATPlike Inactive DFGin 6.1073 13.2684 BLBplus -130.39, 177.17 56.68, 47.87 -99.84, 149.88 40.92, 87.91 73.17, -140.77 out-out out 14.3612 Saltbr-out 12.3822 HRD-out -74.8, 81.36 -67.74, 154.91 out-out-out SNCooo out-out ActLoopNT-out 9.1666 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na -156.54, 146.13 APE9-dihe-na 117.78, -173.39 APE8-dihe-in -67.5, 146.42 APE8-rot-in 282.71 APE67-dihe-in -62.97, -41.04 -80.62, -35.94 APE12-dist-out 14.2949 APE11-dist-out 14.3656 APE10-dist-out 10.6756 APE9-dist-out 7.9092 Q156R,D587E SEP259,SEP621 SEP259,SEP621 EM 3.4 999.0 999.0 A 683.0 348.0 0 30 30 0 [[349, 608]] 1.0 9mmp Homo sapiens TKL_RAF1_HUMAN TKL 2e-80 276.3 3.0 266.0 264.0 485 486 487 489 491 375 393 397 465 467 466 468.0 530 515 510 509 508 507 506 505 504 422 RAF proto-oncogene serine/threonine-protein kinase
TYR ABL1 ABL1_HUMAN 2G2FB P00519 234 502 1130.0 AGS:601 ATPlike Inactive DFGout 13.4774 11.5253 None -73.05, 151.22 -78.4, -31.56 -2.81, -74.15 167.03, 54.1 -90.78, 24.63 in-in in 8.8964 Saltbr-in 3.3728 HRD-out -112.09, 115.32 -73.34, -1.05 in-out-in SNCioi out-in ActLoopNT-out 5.759 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -84.67, 144.36 APE9-dihe-in -134.57, 156.36 APE8-dihe-in -59.22, 104.92 APE8-rot-na 31.18 APE67-dihe-in -59.35, -15.8 -52.01, -51.94 APE12-dist-na 18.8868 APE11-dist-na 14.2996 APE10-dist-na 17.6873 APE9-dist-in 6.8177 H396P None None XRAY 2.7 0.234 0.286 B 287.0 264.0 5 29 29 0 [[242, 495]] 1.0 2g2f Homo sapiens TYR_ABL1_HUMAN TYR 6.9e-100 339.6 1.0 260.0 260.0 380 381 382 384 386 271 286 290 360 362 361 363.0 421 409 404 403 402 401 400 399 398 316 Tyrosine-protein kinase ABL1
TYR EPHA2 EPHA2_HUMAN 5I9VA P29317 605 896 976.0 AGS:1001 ATPlike None DFGin 5.7967 14.9205 BLAminus -141.81, -171.65 57.06, 75.11 -93.17, 20.3 299.55, 97.8 -61.14, -30.9 in-in in 8.6187 Saltbr-in 2.8216 HRD-in -77.85, -47.75 76.63, -12.15 in-in-none SNCiin in-none ActLoopNT-in 2.9177 ActLoopCT-none TYR APEdihe_niiai APEdist_aaai APE10-dihe-none 999.0, 136.3 APE9-dihe-in -111.36, 131.85 APE8-dihe-in -64.26, 123.12 APE8-rot-na 332.19 APE67-dihe-in -77.38, -2.66 -54.41, -44.48 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 10.7119 APE9-dist-in 5.3421 None None None XRAY 1.458 0.164 0.191 A 306.0 279.0 13 31 18 13 [[613, 873]] 1.0 5i9v Homo sapiens TYR_EPHA2_HUMAN TYR 5.5e-108 366.1 2.0 261.0 260.0 756 757 758 760 762 646 663 667 736 738 737 739.0 799 787 782 781 780 779 778 777 776 693 Ephrin type-A receptor 2
TYR PTK2B FAK2_HUMAN 3FZPA Q14289 419 692 1009.0 AGS:999 ATPlike Inactive DFGout 13.1422 11.9545 None -76.23, -175.2 -102.86, 78.24 -127.89, 25.71 251.37, 121.91 162.92, 999.0 in-out in 9.4326 Saltbr-out 4.27 HRD-out -102.53, 130.12 -113.62, 20.17 out-none-in SNConi none-in ActLoopNT-none 999.0 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -45.5, 93.87 APE9-dihe-in -76.94, 158.38 APE8-dihe-in -82.03, 71.77 APE8-rot-na 28.7 APE67-dihe-in -73.32, -11.31 -53.21, -40.06 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-in 7.6516 None None None XRAY 2.1 0.212 0.239 A 277.0 259.0 15 29 14 15 [[425, 681]] 1.0 3fzp Homo sapiens TYR_PTK2B_HUMAN TYR 2.4e-92 314.8 2.0 260.0 259.0 566 567 568 570 572 457 474 478 546 548 547 549.0 607 595 590 589 588 587 586 585 584 503 Protein-tyrosine kinase 2-beta
TYR TYK2-1 TYK2_HUMAN 5C03A P29597 579 869 1187.0 AGS:901 ATPlike Pseudo DFGin 7.3841 13.1047 None -83.93, 173.19 -65.21, 161.12 -79.17, -4.85 20.2, 153.73 66.68, -148.85 in-na in 9.7941 Saltbr-na 999.0 HRD-in -90.34, -65.69 85.25, 3.79 na-out-out SNCaoo out-out ActLoopNT-out 7.8327 ActLoopCT-out TYR APEdihe_oooao APEdist_aaao APE10-dihe-out -60.44, -38.84 APE9-dihe-out -63.06, -21.54 APE8-dihe-out -87.7, -1.06 APE8-rot-na 196.81 APE67-dihe-out -97.84, 8.94 -69.26, 133.75 APE12-dist-na 10.117 APE11-dist-na 12.2506 APE10-dist-na 16.4571 APE9-dist-out 11.202 None None None XRAY 1.9 0.183 0.218 A 342.0 260.0 31 24 24 0 [[589, 868], [897, 1171]] 2.0 5c03 Homo sapiens TYR_TYK2-1_HUMAN TYR 7e-60 208.6 2.0 260.0 259.0 758 759 760 762 764 642 658 662 731 733 732 734.0 796 782 777 776 775 774 773 772 771 688 Non-receptor tyrosine-protein kinase TYK2
TYR TYK2-1 TYK2_HUMAN 5C03B P29597 580 870 1187.0 AGS:901 ATPlike Pseudo DFGin 7.5169 12.8858 None -71.74, 164.11 -66.43, 161.04 -81.86, 0.59 24.73, 148.49 67.14, -147.92 in-na in 9.7089 Saltbr-na 999.0 HRD-in -90.78, -63.58 88.98, 2.52 na-out-out SNCaoo out-out ActLoopNT-out 7.9567 ActLoopCT-out TYR APEdihe_oooao APEdist_aaao APE10-dihe-out -62.24, -42.55 APE9-dihe-out -56.38, -27.94 APE8-dihe-out -85.13, -4.16 APE8-rot-na 194.3 APE67-dihe-out -97.21, 10.32 -66.64, 134.88 APE12-dist-na 9.6347 APE11-dist-na 12.3036 APE10-dist-na 16.4844 APE9-dist-out 11.2214 None None None XRAY 1.9 0.183 0.218 B 342.0 260.0 31 24 24 0 [[589, 868], [897, 1171]] 2.0 5c03 Homo sapiens TYR_TYK2-1_HUMAN TYR 7e-60 208.6 2.0 260.0 259.0 758 759 760 762 764 642 658 662 731 733 732 734.0 796 782 777 776 775 774 773 772 771 688 Non-receptor tyrosine-protein kinase TYK2
CMGC MAPK14 MK14_MOUSE 5NZZE P47811 4 353 360.0 AGS:60401 ATPlike Active DFGin 6.5145 14.9809 BLAminus -122.06, 164.78 72.33, 78.3 -82.97, 27.83 284.83, 92.09 -68.73, -16.77 in-in in 9.4753 Saltbr-in 3.5664 HRD-in -92.47, -52.47 76.16, -3.26 in-in-in SNCiii in-in ActLoopNT-in 2.855 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -134.62, 176.88 APE9-dihe-na 58.43, 166.45 APE8-dihe-in -84.96, 144.19 APE8-rot-in 316.3 APE67-dihe-in -61.16, -25.49 -55.46, -53.03 APE12-dist-in 11.933 APE11-dist-in 11.3947 APE10-dist-in 7.2363 APE9-dist-in 3.1259 None TPO180,PTR182 TPO180,PTR182 XRAY 2.6 0.221 0.271 E 360.0 345.0 5 25 25 0 [[24, 308]] 1.0 5nzz Mus musculus CMGC_MAPK14_MOUSE CMGC 1.9e-85 292.7 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
CMGC MAPK14 MK14_MOUSE 5NZZF P47811 5 353 360.0 AGS:60401 ATPlike Active DFGin 6.5814 14.7457 BLAminus -104.46, 169.41 67.42, 93.44 -106.87, 21.93 284.61, 82.38 -60.31, -14.32 in-in in 9.3181 Saltbr-in 2.6918 HRD-in -84.83, -58.57 70.0, 21.45 in-in-in SNCiii in-in ActLoopNT-in 3.0664 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -161.79, 145.31 APE9-dihe-na 83.88, 162.38 APE8-dihe-in -79.27, 130.51 APE8-rot-in 303.15 APE67-dihe-in -54.1, -23.47 -46.06, -59.5 APE12-dist-in 11.9255 APE11-dist-in 11.5323 APE10-dist-in 7.2453 APE9-dist-in 3.3341 None TPO180,PTR182 TPO180,PTR182 XRAY 2.6 0.221 0.271 F 360.0 343.0 6 25 25 0 [[24, 308]] 1.0 5nzz Mus musculus CMGC_MAPK14_MOUSE CMGC 1.9e-85 292.7 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
CMGC MAPK14 MK14_MOUSE 5NZZG P47811 5 353 360.0 AGS:60500 ATPlike Inactive DFGin 6.7542 14.7083 BLAminus -116.89, 166.61 73.83, 77.69 -92.77, 19.2 291.57, 84.89 -50.42, -23.42 in-out in 9.7677 Saltbr-out 3.6394 HRD-in -81.86, -61.67 80.49, 3.8 out-in-in SNCoii in-in ActLoopNT-in 3.0358 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -160.71, 150.03 APE9-dihe-na 72.19, 148.63 APE8-dihe-in -60.61, 140.23 APE8-rot-in 308.55 APE67-dihe-in -63.92, -23.58 -59.84, -44.11 APE12-dist-in 11.9561 APE11-dist-in 11.829 APE10-dist-in 7.4102 APE9-dist-in 3.3534 None TPO180,PTR182 TPO180,PTR182 XRAY 2.6 0.221 0.271 G 360.0 344.0 5 25 25 0 [[24, 308]] 1.0 5nzz Mus musculus CMGC_MAPK14_MOUSE CMGC 1.9e-85 292.7 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
CMGC MAPK14 MK14_MOUSE 5NZZH P47811 5 352 360.0 AGS:60500 ATPlike None DFGin 6.5201 14.9123 BLAminus -107.76, 173.34 60.28, 95.29 -107.52, 29.84 280.25, 79.55 -61.87, -24.37 in-none in 9.249 Saltbr-none 999.0 HRD-in -88.17, -55.8 88.26, -17.82 none-in-in SNCnii in-in ActLoopNT-in 2.934 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -157.4, 153.2 APE9-dihe-na 72.78, 157.17 APE8-dihe-in -63.99, 158.8 APE8-rot-in 301.47 APE67-dihe-in -70.1, -20.58 -71.77, -51.25 APE12-dist-in 12.0483 APE11-dist-in 11.371 APE10-dist-in 7.6507 APE9-dist-in 3.3502 None TPO180,PTR182 TPO180,PTR182 XRAY 2.6 0.221 0.271 H 360.0 337.0 9 25 25 0 [[24, 308]] 1.0 5nzz Mus musculus CMGC_MAPK14_MOUSE CMGC 1.9e-85 292.7 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
OTHER PKNB PKNB_MYCTU 1MRUA P9WI81 3 286 626.0 AGS:340 ATPlike Inactive DFGin 5.3063 15.1602 ABAminus -133.16, -9.08 -106.78, 121.41 -118.52, 7.05 279.41, 97.11 -53.3, -22.25 in-in in 8.7871 Saltbr-in 3.0975 HRD-out -88.57, 92.36 -74.4, 8.44 in-in-none SNCiin in-none ActLoopNT-in 3.2563 ActLoopCT-none nonTYR APEdihe_aanii APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 68.81 APE8-rot-in 301.37 APE67-dihe-in -58.72, -24.42 -110.36, 19.83 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None XRAY 3.0 0.235 0.297 A 311.0 269.0 15 31 16 15 [[11, 273]] 1.0 1mru Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 7.4e-46 162.5 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 1MRUB P9WI81 1 286 626.0 AGS:440 ATPlike Inactive DFGin 5.6992 14.773 ABAminus -148.24, 16.08 -124.19, 85.51 -86.79, 28.92 287.75, 99.65 -71.04, -20.49 in-in in 8.5809 Saltbr-in 2.7949 HRD-out -73.58, 139.16 -132.94, 35.91 in-in-out SNCiio in-out ActLoopNT-in 2.9453 ActLoopCT-out nonTYR APEdihe_aanoi APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, -24.33 APE8-rot-out 67.38 APE67-dihe-in -83.83, -27.65 -110.75, -0.05 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None XRAY 3.0 0.235 0.297 B 311.0 271.0 15 31 16 15 [[11, 273]] 1.0 1mru Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 7.4e-46 162.5 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORIA P9WI81 10 290 626.0 AGS:340 ATPlike Inactive DFGin 7.6365 16.8211 BLBminus -143.02, 178.07 57.81, 48.97 -59.29, 138.84 275.79, 70.17 -86.17, -173.33 in-out in 9.1936 Saltbr-out 4.9561 HRD-in -67.8, -54.3 82.26, -20.2 out-out-out SNCooo out-out ActLoopNT-out 9.136 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -168.83 APE8-dihe-in -64.13, 155.66 APE8-rot-out 183.22 APE67-dihe-in -72.54, -17.42 -111.5, 12.72 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 9.8257 L33D None None XRAY 2.0 0.204 0.258 A 311.0 267.0 14 31 17 14 [[11, 273]] 1.0 3ori Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORIB P9WI81 10 290 626.0 AGS:440 ATPlike Inactive DFGin 7.6365 16.8215 BLBminus -139.39, 179.89 57.45, 47.17 -55.79, 146.94 279.79, 72.07 -97.71, -175.54 in-out in 9.2388 Saltbr-out 4.9975 HRD-in -67.61, -55.18 81.88, -18.81 out-out-out SNCooo out-out ActLoopNT-out 9.2269 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 169.96 APE8-dihe-in -64.9, 152.58 APE8-rot-out 184.06 APE67-dihe-in -77.2, -13.88 -117.03, 17.8 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 9.8149 L33D None None XRAY 2.0 0.204 0.258 B 311.0 267.0 14 31 17 14 [[11, 273]] 1.0 3ori Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORIC P9WI81 10 290 626.0 AGS:540 ATPlike Inactive DFGin 6.3032 16.0981 BLBminus -143.24, 179.91 57.58, 51.82 -56.21, 134.56 280.51, 73.24 -79.01, -172.14 in-out in 9.1487 Saltbr-out 3.8915 HRD-in -67.31, -55.67 84.26, -16.03 out-out-out SNCooo out-out ActLoopNT-out 9.0858 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -178.78 APE8-dihe-in -60.28, 145.57 APE8-rot-out 180.58 APE67-dihe-in -60.63, -15.55 -107.64, 9.92 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 10.0043 L33D None None XRAY 2.0 0.204 0.258 C 311.0 267.0 14 31 17 14 [[11, 273]] 1.0 3ori Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORID P9WI81 10 290 626.0 AGS:640 ATPlike Inactive DFGin 6.1291 16.0256 BLBminus -145.34, 179.31 58.54, 50.53 -53.37, 134.95 282.91, 74.15 -81.13, -167.82 in-out in 9.4817 Saltbr-out 4.4745 HRD-in -63.25, -53.67 80.9, -20.14 out-out-out SNCooo out-out ActLoopNT-out 9.0601 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 175.93 APE8-dihe-in -58.39, 147.34 APE8-rot-out 181.02 APE67-dihe-in -66.77, -16.29 -111.95, 16.41 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 10.1177 L33D None None XRAY 2.0 0.204 0.258 D 311.0 267.0 14 31 17 14 [[11, 273]] 1.0 3ori Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORKA P9WI81 1 290 626.0 AGS:60340 ATPlike Inactive DFGin 10.4353 16.8257 BLBminus -141.36, 165.33 70.23, 54.74 -85.21, 142.11 285.04, 70.98 89.41, 12.81 in-out in 9.7745 Saltbr-out 6.679 HRD-in -62.7, -55.67 82.9, -12.89 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aanoi APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 163.43 APE8-rot-out 170.93 APE67-dihe-in -64.66, -23.72 -107.64, -2.38 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 L33D None None XRAY 1.6 0.143 0.18 A 311.0 272.0 18 31 13 18 [[11, 273]] 1.0 3ork Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORLA P9WI81 3 289 626.0 AGS:340 ATPlike Inactive DFGin 9.9572 17.2013 BLBminus -144.48, 164.59 73.08, 37.5 -64.08, 144.47 288.67, 77.76 91.89, -143.92 in-out in 9.6079 Saltbr-out 6.8874 HRD-in -62.47, -53.0 58.37, 13.98 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aanoi APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 7.94 APE8-rot-out 197.81 APE67-dihe-in -110.23, 26.08 -69.51, -36.91 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 L33D None None XRAY 2.9 0.214 0.277 A 311.0 268.0 19 31 12 19 [[11, 273]] 1.0 3orl Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORPA P9WI81 1 290 626.0 AGS:340 ATPlike Inactive DFGin 9.997 17.1713 BLBminus -135.07, 165.69 67.81, 58.19 -84.82, 146.71 281.65, 70.56 83.14, 10.92 out-out out 11.1019 Saltbr-out 9.6798 HRD-in -62.59, -57.08 86.57, -17.67 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnoo APE10-dihe-na 999.0, 128.97 APE9-dihe-na 122.96, -174.16 APE8-dihe-in -126.28, 130.92 APE8-rot-out 192.19 APE67-dihe-in -56.98, -18.93 -53.45, -11.47 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 12.2151 APE9-dist-out 10.0698 L33D None None XRAY 2.1 0.191 0.238 A 311.0 274.0 16 31 15 16 [[11, 273]] 1.0 3orp Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORTA P9WI81 1 289 626.0 AGS:340 ATPlike Inactive DFGin 9.6379 17.1872 BLBminus -136.79, 165.29 67.51, 60.14 -88.81, 139.16 278.38, 72.29 78.91, 27.85 out-out out 11.0672 Saltbr-out 9.462 HRD-in -67.64, -48.23 77.18, -14.01 out-out-none SNCoon out-none ActLoopNT-out 9.8276 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -59.9, -24.06 999.0, -8.27 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 L33D None None XRAY 1.9 0.211 0.26 A 311.0 271.0 18 31 13 18 [[11, 273]] 1.0 3ort Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORMA P9WI81 10 289 626.0 AGS:340 ATPlike Inactive DFGin 7.2639 16.3396 BLBminus -148.51, 176.82 57.67, 51.41 -63.33, 131.22 278.23, 70.82 -87.72, -178.85 in-out in 9.3563 Saltbr-out 4.9642 HRD-in -67.03, -60.99 95.31, -14.11 out-out-none SNCoon out-none ActLoopNT-out 9.0248 ActLoopCT-none nonTYR APEdihe_aanii APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, -160.02 APE8-rot-in 323.29 APE67-dihe-in -86.77, -7.05 -150.2, 3.85 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 D76A None None XRAY 2.5 0.218 0.288 A 311.0 266.0 14 31 17 14 [[11, 273]] 1.0 3orm Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.2e-45 161.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3OROA P9WI81 9 288 626.0 AGS:340,NHE:334 ATPlike,Allosteric Inactive DFGin 10.2106 16.6484 BLBminus -142.42, 175.63 58.47, 51.52 -57.61, 135.34 282.11, 75.26 -78.81, -175.89 in-out in 9.5426 Saltbr-out 5.714 HRD-in -71.12, -53.37 79.93, -22.3 out-out-out SNCooo out-out ActLoopNT-out 9.3799 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oioo APE10-dihe-na -107.94, 121.64 APE9-dihe-na -97.08, -109.8 APE8-dihe-out -73.61, -18.41 APE8-rot-out 64.36 APE67-dihe-out -62.49, -21.46 68.3, 11.35 APE12-dist-out 14.3538 APE11-dist-in 10.2286 APE10-dist-out 14.2027 APE9-dist-out 11.3785 L33D None None XRAY 1.9 0.195 0.228 A 311.0 272.0 8 31 23 8 [[11, 273]] 1.0 3oro Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNG PKNG_MYCTU 4Y12A P9WI73 83 404 750.0 AGS:501 ATPlike Inactive DFGin 6.7489 11.5532 BLAminus -118.35, -169.93 53.23, 70.98 -83.76, 10.96 306.02, 8.54 -59.39, -29.43 out-none out 15.3066 Saltbr-none 999.0 HRD-in -74.02, -41.43 68.13, -9.34 none-in-out SNCnio in-out ActLoopNT-in 2.7695 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oiii APE10-dihe-na -55.2, 147.24 APE9-dihe-na -174.29, 175.19 APE8-dihe-in -98.07, 124.48 APE8-rot-in 295.77 APE67-dihe-inflip 103.48, -13.95 -56.73, 132.16 APE12-dist-out 5.5273 APE11-dist-in 10.0724 APE10-dist-in 7.3122 APE9-dist-in 5.6472 None None None XRAY 1.9 0.197 0.212 A 375.0 322.0 0 24 24 0 [[151, 345]] 1.0 4y12 Mycobacterium tuberculosis OTHER_PKNG_MYCTU CAMK 8.2e-22 86.0 1.0 186.0 186.0 292 293 294 296 298 181 198 202 273 275 274 276.0 327 316 311 310 309 308 307 306 305 233 Serine/threonine-protein kinase PknG
OTHER PAN3 PAN3_NEUCR 4BWKA Q7SDP4 235 646 656.0 AGS:1647 ATPlike Pseudo DFGin 8.4954 13.0897 None -115.86, 18.21 -139.38, 20.36 -67.09, 152.08 286.46, 999.0 74.54, -4.0 out-na out 14.2196 Saltbr-na 999.0 HRD-in -64.9, -42.26 69.75, -63.5 na-out-na SNCaoa out-na ActLoopNT-out 6.8983 ActLoopCT-na noAPE APEdihe_aaaaa APEdist_aaaa APE10-dihe-na -56.05, -33.42 APE9-dihe-na -88.79, -48.0 APE8-dihe-na -71.22, -9.91 APE8-rot-na 304.05 APE67-dihe-na -61.19, -29.14 -123.36, 9.46 APE12-dist-na 1.5354 APE11-dist-na 4.8946 APE10-dist-na 5.2051 APE9-dist-na 11.4637 None None None XRAY 3.3 0.254 0.294 A 429.0 392.0 10 15 15 0 [[258, 516]] 1.0 4bwk Neurospora crassa OTHER_PAN3_NEUCR PAN3 3.4e-53 189.3 4.0 264.0 261.0 424 425 426 428 430 302 318 322 405 407 406 408.0 449 439 434 433 432 431 430 429 428 352 PAN2-PAN3 deadenylation complex subunit pan3
OTHER PAN3 PAN3_NEUCR 4BWKB Q7SDP4 235 646 656.0 AGS:1647 ATPlike Pseudo DFGin 8.0984 12.8973 None -116.7, 18.5 -139.0, 22.15 -67.02, 151.82 287.13, 999.0 73.49, -6.49 out-na out 13.8627 Saltbr-na 999.0 HRD-in -66.71, -43.56 68.66, -62.54 na-out-na SNCaoa out-na ActLoopNT-out 6.9009 ActLoopCT-na noAPE APEdihe_aaaaa APEdist_aaaa APE10-dihe-na -57.01, -33.89 APE9-dihe-na -87.36, -45.86 APE8-dihe-na -67.7, -8.98 APE8-rot-na 303.47 APE67-dihe-na -166.92, 999.0 -122.6, 109.05 APE12-dist-na 1.57 APE11-dist-na 4.9263 APE10-dist-na 5.3667 APE9-dist-na 12.4323 None None None XRAY 3.3 0.254 0.294 B 429.0 387.0 14 15 10 5 [[258, 516]] 1.0 4bwk Neurospora crassa OTHER_PAN3_NEUCR PAN3 3.4e-53 189.3 4.0 264.0 261.0 424 425 426 428 430 302 318 322 405 407 406 408.0 449 439 434 433 432 431 430 429 428 352 PAN2-PAN3 deadenylation complex subunit pan3
OTHER PAN3 PAN3_NEUCR 4BWXA Q7SDP4 234 646 656.0 AGS:1647 ATPlike Pseudo DFGin 7.9417 12.8154 None -114.92, 18.69 -139.36, 20.25 -66.2, 154.39 287.13, 999.0 71.2, -3.87 out-na out 14.696 Saltbr-na 999.0 HRD-in -65.26, -41.46 68.71, -60.85 na-out-na SNCaoa out-na ActLoopNT-out 6.8523 ActLoopCT-na noAPE APEdihe_aaaaa APEdist_aaaa APE10-dihe-na -57.52, -32.86 APE9-dihe-na -89.29, -47.03 APE8-dihe-na -70.13, -10.67 APE8-rot-na 304.73 APE67-dihe-na -61.75, -33.62 -123.15, 12.73 APE12-dist-na 1.5381 APE11-dist-na 4.8657 APE10-dist-na 5.325 APE9-dist-na 11.9168 L510M,G511P,G512M,T514G,T515A,H516R,L517F None None XRAY 2.85 0.213 0.242 A 429.0 395.0 10 15 15 0 [[258, 516]] 1.0 4bwx Neurospora crassa OTHER_PAN3_NEUCR PAN3 1.1e-59 210.5 4.0 282.0 279.0 424 425 426 428 430 302 318 322 405 407 406 408.0 449 439 434 433 432 431 430 429 428 352 PAN2-PAN3 deadenylation complex subunit pan3
OTHER PAN3 PAN3_NEUCR 4BWXB Q7SDP4 234 646 656.0 AGS:1647 ATPlike Pseudo DFGin 8.0622 12.9423 None -115.89, 18.73 -138.78, 21.11 -66.02, 153.84 287.45, 999.0 70.44, -4.24 out-na out 13.5168 Saltbr-na 999.0 HRD-in -64.84, -41.41 68.02, -61.18 na-out-na SNCaoa out-na ActLoopNT-out 6.8899 ActLoopCT-na noAPE APEdihe_aaaaa APEdist_aaaa APE10-dihe-na -59.2, -32.89 APE9-dihe-na -88.22, -46.65 APE8-dihe-na -69.2, -11.95 APE8-rot-na 305.01 APE67-dihe-na -59.96, -34.44 -124.18, 13.25 APE12-dist-na 1.54 APE11-dist-na 4.8646 APE10-dist-na 5.3607 APE9-dist-na 12.0065 L510M,G511P,G512M,T514G,T515A,H516R,L517F None None XRAY 2.85 0.213 0.242 B 429.0 397.0 6 15 15 0 [[258, 516]] 1.0 4bwx Neurospora crassa OTHER_PAN3_NEUCR PAN3 1.1e-59 210.5 4.0 282.0 279.0 424 425 426 428 430 302 318 322 405 407 406 408.0 449 439 434 433 432 431 430 429 428 352 PAN2-PAN3 deadenylation complex subunit pan3
OTHER CK2024380 A0A2I0BRS6_PLAFO 9EMYB A0A2I0BRS6 158 560 561.0 AGS:601 ATPlike Inactive None 999.0 999.0 None -145.39, 162.99 101.8, -106.02 79.77, 28.19 309.6, 22.72 -96.04, -12.33 none-na none 999.0 Saltbr-na 999.0 HRD-na- -113.49, -67.93 67.94, 26.82 na-in-in SNCaii in-in ActLoopNT-in 2.9871 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -133.17, 136.58 APE9-dihe-na 57.0, -151.54 APE8-dihe-in -86.93, 149.3 APE8-rot-na 287.05 APE67-dihe-in -64.81, -33.59 -59.14, -29.11 APE12-dist-in 12.5003 APE11-dist-in 9.9547 APE10-dist-in 6.4399 APE9-dist-in 3.564 None None None XRAY 2.814 0.245 0.286 B 413.0 379.0 33 41 41 0 [[30, 557]] 1.0 9emy Plasmodium falciparum OTHER_CK2024380_PLAFO CAMK 2.1e-05 40.5 53.0 169.0 169.0 397 398 399 401 403 0 0 0 376 378 377 379.0 0 438 433 432 431 430 429 428 427 328 non-specific serine/threonine protein kinase
OTHER CK2024380 A0A2I0BRS6_PLAFO 9EMYG A0A2I0BRS6 157 559 561.0 AGS:601 ATPlike Inactive None 999.0 999.0 None -141.12, 148.64 103.02, -106.09 77.78, 35.92 314.51, 14.85 -99.55, -19.73 none-na none 999.0 Saltbr-na 999.0 HRD-na- -114.36, -67.58 67.5, 26.88 na-in-in SNCaii in-in ActLoopNT-in 3.0012 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -133.47, 138.55 APE9-dihe-na 54.28, -150.57 APE8-dihe-in -87.01, 148.15 APE8-rot-na 293.5 APE67-dihe-in -65.24, -33.74 -57.89, -29.62 APE12-dist-in 12.4517 APE11-dist-in 9.9116 APE10-dist-in 6.3925 APE9-dist-in 3.5499 None None None XRAY 2.814 0.245 0.286 G 413.0 369.0 42 41 41 0 [[30, 557]] 1.0 9emy Plasmodium falciparum OTHER_CK2024380_PLAFO CAMK 2.1e-05 40.5 53.0 169.0 169.0 397 398 399 401 403 0 0 0 376 378 377 379.0 0 438 433 432 431 430 429 428 427 328 non-specific serine/threonine protein kinase
OTHER CK2024380 A0A2I0BRS6_PLAFO 9EMYH A0A2I0BRS6 158 560 561.0 AGS:601 ATPlike Inactive None 999.0 999.0 None -144.83, 160.67 101.1, -105.16 80.03, 28.42 309.86, 22.51 -95.63, -12.4 none-na none 999.0 Saltbr-na 999.0 HRD-na- -113.38, -68.75 67.74, 26.85 na-in-in SNCaii in-in ActLoopNT-in 2.9864 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -132.96, 137.76 APE9-dihe-na 56.9, -145.47 APE8-dihe-in -87.0, 158.51 APE8-rot-na 279.85 APE67-dihe-in -66.03, -33.57 -63.08, -32.03 APE12-dist-in 12.5339 APE11-dist-in 9.9708 APE10-dist-in 6.4221 APE9-dist-in 3.5502 None None None XRAY 2.814 0.245 0.286 H 413.0 375.0 37 41 41 0 [[30, 557]] 1.0 9emy Plasmodium falciparum OTHER_CK2024380_PLAFO CAMK 2.1e-05 40.5 53.0 169.0 169.0 397 398 399 401 403 0 0 0 376 378 377 379.0 0 438 433 432 431 430 429 428 427 328 non-specific serine/threonine protein kinase
OTHER CK2024380 A0A2I0BRS6_PLAFO 9EMYA A0A2I0BRS6 157 561 561.0 AGS:601,PE4:602 ATPlike,Allosteric Inactive None 999.0 999.0 None -141.05, 146.83 102.18, -104.97 80.11, 29.42 313.02, 18.48 -97.07, -12.64 none-na none 999.0 Saltbr-na 999.0 HRD-na- -113.81, -67.49 68.91, 22.97 na-in-in SNCaii in-in ActLoopNT-in 2.9972 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -133.3, 137.35 APE9-dihe-na 55.54, -152.24 APE8-dihe-in -84.79, 148.26 APE8-rot-na 286.36 APE67-dihe-in -66.38, -33.03 -58.56, -29.39 APE12-dist-in 12.5559 APE11-dist-in 9.9876 APE10-dist-in 6.4693 APE9-dist-in 3.566 None None None XRAY 2.814 0.245 0.286 A 413.0 370.0 43 41 41 0 [[30, 557]] 1.0 9emy Plasmodium falciparum OTHER_CK2024380_PLAFO CAMK 2.1e-05 40.5 53.0 169.0 169.0 397 398 399 401 403 0 0 0 376 378 377 379.0 0 438 433 432 431 430 429 428 427 328 non-specific serine/threonine protein kinase
CMGC PHO85 PHO85_YEAST 2PMIA P17157 19 302 305.0 AGS:3001 ATPlike Inactive DFGin 7.2372 15.7955 BLAminus -131.09, -173.7 33.09, 89.33 -97.7, 25.38 282.26, 72.33 -62.33, -32.91 in-in in 8.5936 Saltbr-in 3.4251 HRD-in -72.44, -45.76 70.96, -7.13 in-in-out SNCiio in-out ActLoopNT-in 3.1022 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oioo APE10-dihe-na -114.99, 160.84 APE9-dihe-na -76.95, -23.6 APE8-dihe-in -133.88, 153.14 APE8-rot-out 49.79 APE67-dihe-in -62.43, -18.36 -117.43, 12.38 APE12-dist-out 6.6884 APE11-dist-in 10.4946 APE10-dist-out 8.9487 APE9-dist-out 10.5636 None None None XRAY 2.9 0.289 0.325 A 317.0 284.0 12 28 28 0 [[7, 297]] 1.0 2pmi Saccharomyces cerevisiae CMGC_PHO85_YEAST CMGC 9.7e-87 296.9 1.0 301.0 301.0 150 151 152 154 156 36 53 57 130 132 131 133.0 191 178 173 172 171 170 169 168 167 83 Cyclin-dependent protein kinase PHO85
CMGC PHO85 PHO85_YEAST 4KRCA P17157 2 302 305.0 AGS:402 ATPlike Inactive DFGin 7.4164 14.7519 BLAminus -136.61, -172.43 62.42, 59.22 -84.0, 19.74 286.1, 74.64 -64.06, -31.05 in-in in 7.9988 Saltbr-in 2.6892 HRD-in -80.52, -46.39 66.38, 2.32 in-in-out SNCiio in-out ActLoopNT-in 2.8038 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -96.44, 159.67 APE9-dihe-na 75.67, 119.42 APE8-dihe-in -55.3, 135.35 APE8-rot-out 107.93 APE67-dihe-in -57.74, -17.26 -41.11, -48.02 APE12-dist-in 13.0944 APE11-dist-in 10.8151 APE10-dist-in 6.1008 APE9-dist-in 3.0869 None None None XRAY 2.597 0.207 0.27 A 317.0 297.0 4 28 28 0 [[7, 297]] 1.0 4krc Saccharomyces cerevisiae CMGC_PHO85_YEAST CMGC 9.7e-87 296.9 1.0 301.0 301.0 150 151 152 154 156 36 53 57 130 132 131 133.0 191 178 173 172 171 170 169 168 167 83 Cyclin-dependent protein kinase PHO85
OTHER CDC7 CDC7_YEAST 7PT68 P06243 10 475 507.0 AGS:1001 ATPlike Inactive DFGin 6.5704 14.3798 ABAminus -105.18, -52.81 -73.02, 144.04 -146.73, 7.18 274.51, 95.44 -55.63, -34.23 in-in in 8.6106 Saltbr-in 2.8556 HRD-out -82.55, 76.99 -43.85, -49.64 in-in-in SNCiii in-in ActLoopNT-in 2.7548 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -61.89, 138.79 APE9-dihe-na 154.11, -158.58 APE8-dihe-in -131.43, 137.43 APE8-rot-in 301.28 APE67-dihe-inflip 83.88, -1.28 -44.87, 132.79 APE12-dist-in 9.0231 APE11-dist-in 10.8046 APE10-dist-in 4.8485 APE9-dist-in 4.6606 None None None EM 3.2 999.0 999.0 8 507.0 402.0 64 107 61 46 [[33, 469]] 1.0 7pt6 Saccharomyces cerevisiae OTHER_CDC7_YEAST CMGC 4e-17 121.0 1.0 158.0 260.0 181 182 183 185 187 76 90 94 160 162 161 163.0 301 288 283 282 281 280 279 278 277 121 Cell division control protein 7
OTHER CDC7 CDC7_YEAST 7PT6H P06243 10 475 507.0 AGS:1001 ATPlike Inactive DFGin 6.5701 14.3794 ABAminus -105.26, -52.78 -73.04, 144.07 -146.75, 7.22 274.49, 95.39 -55.64, -34.26 in-in in 8.61 Saltbr-in 2.856 HRD-out -82.58, 77.02 -43.85, -49.65 in-in-in SNCiii in-in ActLoopNT-in 2.7551 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -61.95, 138.81 APE9-dihe-na 154.08, -158.6 APE8-dihe-in -131.38, 137.47 APE8-rot-in 301.27 APE67-dihe-inflip 83.81, -1.31 -44.91, 132.85 APE12-dist-in 9.0241 APE11-dist-in 10.8052 APE10-dist-in 4.8487 APE9-dist-in 4.6608 None None None EM 3.2 999.0 999.0 H 507.0 402.0 64 107 61 46 [[33, 469]] 1.0 7pt6 Saccharomyces cerevisiae OTHER_CDC7_YEAST CMGC 4e-17 121.0 1.0 158.0 260.0 181 182 183 185 187 76 90 94 160 162 161 163.0 301 288 283 282 281 280 279 278 277 121 Cell division control protein 7
OTHER CDC7 CDC7_YEAST 7V3VH P06243 12 473 507.0 AGS:2001 ATPlike Inactive DFGin 7.406 15.0611 BLAminus -128.9, -172.48 62.33, 64.7 -96.34, 20.92 294.13, 91.42 -71.72, -23.69 in-in in 9.7148 Saltbr-in 2.9774 HRD-in -91.43, -47.78 57.88, 18.12 in-in-out SNCiio in-out ActLoopNT-in 2.927 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -143.2, 5.85 APE9-dihe-na -75.12, -172.29 APE8-dihe-in -97.45, 157.79 APE8-rot-out 187.23 APE67-dihe-inflip 88.73, -6.04 -67.06, 131.23 APE12-dist-in 9.828 APE11-dist-in 11.6406 APE10-dist-in 5.8595 APE9-dist-in 3.5117 None None None EM 2.9 999.0 999.0 H 507.0 381.0 81 107 45 62 [[33, 469]] 1.0 7v3v Saccharomyces cerevisiae OTHER_CDC7_YEAST CMGC 4e-17 121.0 1.0 158.0 260.0 181 182 183 185 187 76 90 94 160 162 161 163.0 301 288 283 282 281 280 279 278 277 121 Cell division control protein 7

Ligand: AGS

Total number of chains: 36
Active chains: 6
Total number of genes: 9
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 12 33.3% 4Y12A
DFGin BLBminus 10 27.8% 3OROA
DFGin None 6 16.7% 6Z4XB
DFGin ABAminus 4 11.1% 1MRUA
None None 4 11.1% 9EMYB
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

Group Gene SwissprotID PDB UniprotID First_obs_res Last_obs_res Length_Unp Ligand Ligand_type Activity_label Spatial_label Phe_Glu4_dis Phe_Lys_dis Dihedral_label XDFG
φ,ψ		 DFG-Asp
φ,ψ		 DFG-Phe
φ,ψ		 DFG-Phe
χ1,χ2		 DFG-Gly
φ,ψ		 ChelixSaltbr_label Chelix_label Lys_Glu_dis Saltbr_label LysNZ_GluOE_dis HRD_label His φ,ψ Arg φ,ψ SNC_label SNCpymol_label ActLoop_label ActLoopNT_label DFG6_XHRD_dis ActLoopCT_label APEtype APEdihe_label APEdist_label APE10_dihe_label APE10 φ,ψ APE9_dihe_label APE9 φ,ψ APE8_dihe_label APE8 φ,ψ APE8_rotamer_label APE8 χ1 APE67_label APE6 φ,ψ APE7 φ,ψ APE12_dist_label APE12_DFG4_dis APE11_dist_label APE11_DFG4_dis APE10_dist_label APE10_DFG4_dis APE9_dist_label APE9_Arg_dis Chain_mut Chain_phos Modified_aa Method Resolution Rvalue FreeRvalue Chain_id ChainLen Ordered_residues DomainBreak ActLoopLength ActLoopResolvedResidues ActLoopDisorderedResidues Kinase_domains_Unp N_Kinase_domains_Unp pdb Species Kincore_name hmm Evalue Score hmmbeg hmmend hmmlen XDFGnum DFGnum PHEnum DFG4num DFG6num LYSnum GLUnum GLU4num XHRDnum ARGnum HRDnum HRDaspnum aFaspnum APEnum APE6num APE7num APE8num APE9num APE10num APE11num APE12num Hinge1num Protein_name
CMGC CDK7 G0SFC6_CHATD 6Z4XB G0SFC6 78 399 437.0 AGS:501 ATPlike Inactive DFGin 6.0664 15.963 None -120.32, -64.48 -72.18, 111.3 -111.88, 18.28 274.56, 83.55 -65.42, -11.7 in-out in 8.9011 Saltbr-out 3.7194 HRD-in -82.6, -50.25 63.05, 25.15 out-in-in SNCoii in-in ActLoopNT-in 2.7476 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -143.45, 163.36 APE9-dihe-na 70.87, 128.98 APE8-dihe-in -54.32, 144.95 APE8-rot-in 303.7 APE67-dihe-in -58.5, -22.2 -48.9, -49.43 APE12-dist-in 13.1214 APE11-dist-in 10.3276 APE10-dist-in 6.1584 APE9-dist-in 3.0434 None None None XRAY 2.98 0.205 0.246 B 437.0 322.0 0 28 28 0 [[92, 383]] 1.0 6z4x Chaetomium thermophilum CMGC_CDK7_CHATD CMGC 1.5e-61 214.7 2.0 300.0 299.0 237 238 239 241 243 122 141 145 217 219 218 220.0 278 265 260 259 258 257 256 255 254 173 Protein kinase domain-containing protein
CMGC CDK7 G0SFC6_CHATD 6Z4XE G0SFC6 77 399 437.0 AGS:501 ATPlike Inactive DFGin 6.0452 15.8914 None -120.83, -65.38 -72.38, 111.16 -111.28, 19.39 275.38, 85.23 -65.84, -12.59 in-out in 8.9023 Saltbr-out 3.6666 HRD-in -79.74, -48.62 65.81, 23.05 out-in-in SNCoii in-in ActLoopNT-in 2.907 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -144.65, 161.76 APE9-dihe-na 74.19, 130.39 APE8-dihe-in -54.74, 142.95 APE8-rot-in 302.5 APE67-dihe-in -58.43, -23.34 -50.65, -48.02 APE12-dist-in 13.252 APE11-dist-in 10.4227 APE10-dist-in 6.1469 APE9-dist-in 3.1587 None None None XRAY 2.98 0.205 0.246 E 437.0 323.0 0 28 28 0 [[92, 383]] 1.0 6z4x Chaetomium thermophilum CMGC_CDK7_CHATD CMGC 1.5e-61 214.7 2.0 300.0 299.0 237 238 239 241 243 122 141 145 217 219 218 220.0 278 265 260 259 258 257 256 255 254 173 Protein kinase domain-containing protein
TYR SRC SRC_CHICK 3DQWA P00523 255 533 533.0 AGS:534 ATPlike Active DFGin 6.3569 14.1326 BLAminus -133.72, -176.8 56.69, 80.14 -98.42, 17.02 297.52, 87.02 -49.14, -41.19 in-in in 7.931 Saltbr-in 2.6874 HRD-in -86.31, -48.96 78.42, -4.92 in-in-in SNCiii in-in ActLoopNT-in 3.0136 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -125.37, 137.46 APE9-dihe-in -129.59, 150.85 APE8-dihe-in -68.35, 111.94 APE8-rot-na 22.98 APE67-dihe-in -63.37, -24.29 -54.33, -47.45 APE12-dist-na 14.4541 APE11-dist-na 9.9175 APE10-dist-na 12.7255 APE9-dist-in 6.8354 T338I PTR416 PTR416 XRAY 2.017 0.207 0.245 A 286.0 279.0 0 29 29 0 [[267, 518]] 1.0 3dqw Gallus gallus TYR_SRC_CHICK TYR 6.7e-94 319.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
TYR SRC SRC_CHICK 3DQWB P00523 255 533 533.0 AGS:534 ATPlike Active DFGin 6.515 14.1123 BLAminus -130.32, -179.28 59.57, 78.46 -98.37, 14.52 296.04, 88.38 -51.47, -39.24 in-in in 7.8608 Saltbr-in 2.5941 HRD-in -92.73, -49.37 74.2, -0.04 in-in-in SNCiii in-in ActLoopNT-in 2.9546 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -118.73, 138.44 APE9-dihe-in -131.19, 150.2 APE8-dihe-in -68.24, 113.76 APE8-rot-na 20.72 APE67-dihe-in -68.02, -21.16 -58.05, -42.12 APE12-dist-na 14.5771 APE11-dist-na 10.0679 APE10-dist-na 12.667 APE9-dist-in 6.8354 T338I PTR416 PTR416 XRAY 2.017 0.207 0.245 B 286.0 279.0 0 29 29 0 [[267, 518]] 1.0 3dqw Gallus gallus TYR_SRC_CHICK TYR 6.7e-94 319.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
TYR SRC SRC_CHICK 3DQWC P00523 258 533 533.0 AGS:534 ATPlike Active DFGin 7.2297 15.5864 BLAminus -138.39, -169.49 49.44, 64.48 -88.87, 22.55 279.28, 86.64 -59.44, -34.1 in-in in 7.6659 Saltbr-in 3.0464 HRD-in -87.18, -49.68 80.05, -15.46 in-in-in SNCiii in-in ActLoopNT-in 2.9359 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -114.69, 105.75 APE9-dihe-in -126.06, 131.23 APE8-dihe-in -49.28, 106.82 APE8-rot-na 333.72 APE67-dihe-in -71.67, -16.03 -52.29, -42.49 APE12-dist-na 14.0713 APE11-dist-na 9.8506 APE10-dist-na 10.9474 APE9-dist-in 6.1241 T338I PTR416 PTR416 XRAY 2.017 0.207 0.245 C 286.0 276.0 0 29 29 0 [[267, 518]] 1.0 3dqw Gallus gallus TYR_SRC_CHICK TYR 6.7e-94 319.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
TYR SRC SRC_CHICK 3DQWD P00523 257 533 533.0 AGS:534 ATPlike Active DFGin 7.1829 15.4998 BLAminus -135.25, -176.07 62.11, 64.12 -89.05, 15.75 281.43, 79.51 -51.86, -37.09 in-in in 7.529 Saltbr-in 3.0179 HRD-in -81.74, -56.17 86.4, -15.46 in-in-in SNCiii in-in ActLoopNT-in 2.9706 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -120.41, 149.47 APE9-dihe-in -128.09, 155.96 APE8-dihe-in -55.17, 98.07 APE8-rot-na 334.76 APE67-dihe-in -67.99, -16.44 -49.1, -40.45 APE12-dist-na 15.0709 APE11-dist-na 10.3048 APE10-dist-na 13.2932 APE9-dist-in 6.675 T338I PTR416 PTR416 XRAY 2.017 0.207 0.245 D 286.0 277.0 0 29 29 0 [[267, 518]] 1.0 3dqw Gallus gallus TYR_SRC_CHICK TYR 6.7e-94 319.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
CMGC MAPK14 MK14_MOUSE 5NZZE P47811 4 353 360.0 AGS:60401 ATPlike Active DFGin 6.5145 14.9809 BLAminus -122.06, 164.78 72.33, 78.3 -82.97, 27.83 284.83, 92.09 -68.73, -16.77 in-in in 9.4753 Saltbr-in 3.5664 HRD-in -92.47, -52.47 76.16, -3.26 in-in-in SNCiii in-in ActLoopNT-in 2.855 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -134.62, 176.88 APE9-dihe-na 58.43, 166.45 APE8-dihe-in -84.96, 144.19 APE8-rot-in 316.3 APE67-dihe-in -61.16, -25.49 -55.46, -53.03 APE12-dist-in 11.933 APE11-dist-in 11.3947 APE10-dist-in 7.2363 APE9-dist-in 3.1259 None TPO180,PTR182 TPO180,PTR182 XRAY 2.6 0.221 0.271 E 360.0 345.0 5 25 25 0 [[24, 308]] 1.0 5nzz Mus musculus CMGC_MAPK14_MOUSE CMGC 1.9e-85 292.7 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
CMGC MAPK14 MK14_MOUSE 5NZZF P47811 5 353 360.0 AGS:60401 ATPlike Active DFGin 6.5814 14.7457 BLAminus -104.46, 169.41 67.42, 93.44 -106.87, 21.93 284.61, 82.38 -60.31, -14.32 in-in in 9.3181 Saltbr-in 2.6918 HRD-in -84.83, -58.57 70.0, 21.45 in-in-in SNCiii in-in ActLoopNT-in 3.0664 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -161.79, 145.31 APE9-dihe-na 83.88, 162.38 APE8-dihe-in -79.27, 130.51 APE8-rot-in 303.15 APE67-dihe-in -54.1, -23.47 -46.06, -59.5 APE12-dist-in 11.9255 APE11-dist-in 11.5323 APE10-dist-in 7.2453 APE9-dist-in 3.3341 None TPO180,PTR182 TPO180,PTR182 XRAY 2.6 0.221 0.271 F 360.0 343.0 6 25 25 0 [[24, 308]] 1.0 5nzz Mus musculus CMGC_MAPK14_MOUSE CMGC 1.9e-85 292.7 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
CMGC MAPK14 MK14_MOUSE 5NZZG P47811 5 353 360.0 AGS:60500 ATPlike Inactive DFGin 6.7542 14.7083 BLAminus -116.89, 166.61 73.83, 77.69 -92.77, 19.2 291.57, 84.89 -50.42, -23.42 in-out in 9.7677 Saltbr-out 3.6394 HRD-in -81.86, -61.67 80.49, 3.8 out-in-in SNCoii in-in ActLoopNT-in 3.0358 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -160.71, 150.03 APE9-dihe-na 72.19, 148.63 APE8-dihe-in -60.61, 140.23 APE8-rot-in 308.55 APE67-dihe-in -63.92, -23.58 -59.84, -44.11 APE12-dist-in 11.9561 APE11-dist-in 11.829 APE10-dist-in 7.4102 APE9-dist-in 3.3534 None TPO180,PTR182 TPO180,PTR182 XRAY 2.6 0.221 0.271 G 360.0 344.0 5 25 25 0 [[24, 308]] 1.0 5nzz Mus musculus CMGC_MAPK14_MOUSE CMGC 1.9e-85 292.7 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
CMGC MAPK14 MK14_MOUSE 5NZZH P47811 5 352 360.0 AGS:60500 ATPlike None DFGin 6.5201 14.9123 BLAminus -107.76, 173.34 60.28, 95.29 -107.52, 29.84 280.25, 79.55 -61.87, -24.37 in-none in 9.249 Saltbr-none 999.0 HRD-in -88.17, -55.8 88.26, -17.82 none-in-in SNCnii in-in ActLoopNT-in 2.934 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -157.4, 153.2 APE9-dihe-na 72.78, 157.17 APE8-dihe-in -63.99, 158.8 APE8-rot-in 301.47 APE67-dihe-in -70.1, -20.58 -71.77, -51.25 APE12-dist-in 12.0483 APE11-dist-in 11.371 APE10-dist-in 7.6507 APE9-dist-in 3.3502 None TPO180,PTR182 TPO180,PTR182 XRAY 2.6 0.221 0.271 H 360.0 337.0 9 25 25 0 [[24, 308]] 1.0 5nzz Mus musculus CMGC_MAPK14_MOUSE CMGC 1.9e-85 292.7 1.0 301.0 301.0 167 168 169 171 173 53 71 75 147 149 148 150.0 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
OTHER PKNB PKNB_MYCTU 1MRUA P9WI81 3 286 626.0 AGS:340 ATPlike Inactive DFGin 5.3063 15.1602 ABAminus -133.16, -9.08 -106.78, 121.41 -118.52, 7.05 279.41, 97.11 -53.3, -22.25 in-in in 8.7871 Saltbr-in 3.0975 HRD-out -88.57, 92.36 -74.4, 8.44 in-in-none SNCiin in-none ActLoopNT-in 3.2563 ActLoopCT-none nonTYR APEdihe_aanii APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 68.81 APE8-rot-in 301.37 APE67-dihe-in -58.72, -24.42 -110.36, 19.83 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None XRAY 3.0 0.235 0.297 A 311.0 269.0 15 31 16 15 [[11, 273]] 1.0 1mru Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 7.4e-46 162.5 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 1MRUB P9WI81 1 286 626.0 AGS:440 ATPlike Inactive DFGin 5.6992 14.773 ABAminus -148.24, 16.08 -124.19, 85.51 -86.79, 28.92 287.75, 99.65 -71.04, -20.49 in-in in 8.5809 Saltbr-in 2.7949 HRD-out -73.58, 139.16 -132.94, 35.91 in-in-out SNCiio in-out ActLoopNT-in 2.9453 ActLoopCT-out nonTYR APEdihe_aanoi APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, -24.33 APE8-rot-out 67.38 APE67-dihe-in -83.83, -27.65 -110.75, -0.05 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None XRAY 3.0 0.235 0.297 B 311.0 271.0 15 31 16 15 [[11, 273]] 1.0 1mru Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 7.4e-46 162.5 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORIA P9WI81 10 290 626.0 AGS:340 ATPlike Inactive DFGin 7.6365 16.8211 BLBminus -143.02, 178.07 57.81, 48.97 -59.29, 138.84 275.79, 70.17 -86.17, -173.33 in-out in 9.1936 Saltbr-out 4.9561 HRD-in -67.8, -54.3 82.26, -20.2 out-out-out SNCooo out-out ActLoopNT-out 9.136 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -168.83 APE8-dihe-in -64.13, 155.66 APE8-rot-out 183.22 APE67-dihe-in -72.54, -17.42 -111.5, 12.72 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 9.8257 L33D None None XRAY 2.0 0.204 0.258 A 311.0 267.0 14 31 17 14 [[11, 273]] 1.0 3ori Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORIB P9WI81 10 290 626.0 AGS:440 ATPlike Inactive DFGin 7.6365 16.8215 BLBminus -139.39, 179.89 57.45, 47.17 -55.79, 146.94 279.79, 72.07 -97.71, -175.54 in-out in 9.2388 Saltbr-out 4.9975 HRD-in -67.61, -55.18 81.88, -18.81 out-out-out SNCooo out-out ActLoopNT-out 9.2269 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 169.96 APE8-dihe-in -64.9, 152.58 APE8-rot-out 184.06 APE67-dihe-in -77.2, -13.88 -117.03, 17.8 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 9.8149 L33D None None XRAY 2.0 0.204 0.258 B 311.0 267.0 14 31 17 14 [[11, 273]] 1.0 3ori Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORIC P9WI81 10 290 626.0 AGS:540 ATPlike Inactive DFGin 6.3032 16.0981 BLBminus -143.24, 179.91 57.58, 51.82 -56.21, 134.56 280.51, 73.24 -79.01, -172.14 in-out in 9.1487 Saltbr-out 3.8915 HRD-in -67.31, -55.67 84.26, -16.03 out-out-out SNCooo out-out ActLoopNT-out 9.0858 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -178.78 APE8-dihe-in -60.28, 145.57 APE8-rot-out 180.58 APE67-dihe-in -60.63, -15.55 -107.64, 9.92 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 10.0043 L33D None None XRAY 2.0 0.204 0.258 C 311.0 267.0 14 31 17 14 [[11, 273]] 1.0 3ori Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORID P9WI81 10 290 626.0 AGS:640 ATPlike Inactive DFGin 6.1291 16.0256 BLBminus -145.34, 179.31 58.54, 50.53 -53.37, 134.95 282.91, 74.15 -81.13, -167.82 in-out in 9.4817 Saltbr-out 4.4745 HRD-in -63.25, -53.67 80.9, -20.14 out-out-out SNCooo out-out ActLoopNT-out 9.0601 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 175.93 APE8-dihe-in -58.39, 147.34 APE8-rot-out 181.02 APE67-dihe-in -66.77, -16.29 -111.95, 16.41 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 10.1177 L33D None None XRAY 2.0 0.204 0.258 D 311.0 267.0 14 31 17 14 [[11, 273]] 1.0 3ori Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORKA P9WI81 1 290 626.0 AGS:60340 ATPlike Inactive DFGin 10.4353 16.8257 BLBminus -141.36, 165.33 70.23, 54.74 -85.21, 142.11 285.04, 70.98 89.41, 12.81 in-out in 9.7745 Saltbr-out 6.679 HRD-in -62.7, -55.67 82.9, -12.89 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aanoi APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 163.43 APE8-rot-out 170.93 APE67-dihe-in -64.66, -23.72 -107.64, -2.38 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 L33D None None XRAY 1.6 0.143 0.18 A 311.0 272.0 18 31 13 18 [[11, 273]] 1.0 3ork Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORLA P9WI81 3 289 626.0 AGS:340 ATPlike Inactive DFGin 9.9572 17.2013 BLBminus -144.48, 164.59 73.08, 37.5 -64.08, 144.47 288.67, 77.76 91.89, -143.92 in-out in 9.6079 Saltbr-out 6.8874 HRD-in -62.47, -53.0 58.37, 13.98 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aanoi APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 7.94 APE8-rot-out 197.81 APE67-dihe-in -110.23, 26.08 -69.51, -36.91 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 L33D None None XRAY 2.9 0.214 0.277 A 311.0 268.0 19 31 12 19 [[11, 273]] 1.0 3orl Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORPA P9WI81 1 290 626.0 AGS:340 ATPlike Inactive DFGin 9.997 17.1713 BLBminus -135.07, 165.69 67.81, 58.19 -84.82, 146.71 281.65, 70.56 83.14, 10.92 out-out out 11.1019 Saltbr-out 9.6798 HRD-in -62.59, -57.08 86.57, -17.67 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnoo APE10-dihe-na 999.0, 128.97 APE9-dihe-na 122.96, -174.16 APE8-dihe-in -126.28, 130.92 APE8-rot-out 192.19 APE67-dihe-in -56.98, -18.93 -53.45, -11.47 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 12.2151 APE9-dist-out 10.0698 L33D None None XRAY 2.1 0.191 0.238 A 311.0 274.0 16 31 15 16 [[11, 273]] 1.0 3orp Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORTA P9WI81 1 289 626.0 AGS:340 ATPlike Inactive DFGin 9.6379 17.1872 BLBminus -136.79, 165.29 67.51, 60.14 -88.81, 139.16 278.38, 72.29 78.91, 27.85 out-out out 11.0672 Saltbr-out 9.462 HRD-in -67.64, -48.23 77.18, -14.01 out-out-none SNCoon out-none ActLoopNT-out 9.8276 ActLoopCT-none nonTYR APEdihe_aannn APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 999.0 APE8-rot-none 999.0 APE67-dihe-none -59.9, -24.06 999.0, -8.27 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 L33D None None XRAY 1.9 0.211 0.26 A 311.0 271.0 18 31 13 18 [[11, 273]] 1.0 3ort Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3ORMA P9WI81 10 289 626.0 AGS:340 ATPlike Inactive DFGin 7.2639 16.3396 BLBminus -148.51, 176.82 57.67, 51.41 -63.33, 131.22 278.23, 70.82 -87.72, -178.85 in-out in 9.3563 Saltbr-out 4.9642 HRD-in -67.03, -60.99 95.31, -14.11 out-out-none SNCoon out-none ActLoopNT-out 9.0248 ActLoopCT-none nonTYR APEdihe_aanii APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, -160.02 APE8-rot-in 323.29 APE67-dihe-in -86.77, -7.05 -150.2, 3.85 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 D76A None None XRAY 2.5 0.218 0.288 A 311.0 266.0 14 31 17 14 [[11, 273]] 1.0 3orm Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.2e-45 161.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNB PKNB_MYCTU 3OROA P9WI81 9 288 626.0 AGS:340,NHE:334 ATPlike,Allosteric Inactive DFGin 10.2106 16.6484 BLBminus -142.42, 175.63 58.47, 51.52 -57.61, 135.34 282.11, 75.26 -78.81, -175.89 in-out in 9.5426 Saltbr-out 5.714 HRD-in -71.12, -53.37 79.93, -22.3 out-out-out SNCooo out-out ActLoopNT-out 9.3799 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oioo APE10-dihe-na -107.94, 121.64 APE9-dihe-na -97.08, -109.8 APE8-dihe-out -73.61, -18.41 APE8-rot-out 64.36 APE67-dihe-out -62.49, -21.46 68.3, 11.35 APE12-dist-out 14.3538 APE11-dist-in 10.2286 APE10-dist-out 14.2027 APE9-dist-out 11.3785 L33D None None XRAY 1.9 0.195 0.228 A 311.0 272.0 8 31 23 8 [[11, 273]] 1.0 3oro Mycobacterium tuberculosis OTHER_PKNB_MYCTU CAMK 2.7e-46 164.0 1.0 248.0 248.0 155 156 157 159 161 40 59 63 135 137 136 138.0 198 186 181 180 179 178 177 176 175 93 Serine/threonine-protein kinase PknB
OTHER PKNG PKNG_MYCTU 4Y12A P9WI73 83 404 750.0 AGS:501 ATPlike Inactive DFGin 6.7489 11.5532 BLAminus -118.35, -169.93 53.23, 70.98 -83.76, 10.96 306.02, 8.54 -59.39, -29.43 out-none out 15.3066 Saltbr-none 999.0 HRD-in -74.02, -41.43 68.13, -9.34 none-in-out SNCnio in-out ActLoopNT-in 2.7695 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oiii APE10-dihe-na -55.2, 147.24 APE9-dihe-na -174.29, 175.19 APE8-dihe-in -98.07, 124.48 APE8-rot-in 295.77 APE67-dihe-inflip 103.48, -13.95 -56.73, 132.16 APE12-dist-out 5.5273 APE11-dist-in 10.0724 APE10-dist-in 7.3122 APE9-dist-in 5.6472 None None None XRAY 1.9 0.197 0.212 A 375.0 322.0 0 24 24 0 [[151, 345]] 1.0 4y12 Mycobacterium tuberculosis OTHER_PKNG_MYCTU CAMK 8.2e-22 86.0 1.0 186.0 186.0 292 293 294 296 298 181 198 202 273 275 274 276.0 327 316 311 310 309 308 307 306 305 233 Serine/threonine-protein kinase PknG
OTHER PAN3 PAN3_NEUCR 4BWKA Q7SDP4 235 646 656.0 AGS:1647 ATPlike Pseudo DFGin 8.4954 13.0897 None -115.86, 18.21 -139.38, 20.36 -67.09, 152.08 286.46, 999.0 74.54, -4.0 out-na out 14.2196 Saltbr-na 999.0 HRD-in -64.9, -42.26 69.75, -63.5 na-out-na SNCaoa out-na ActLoopNT-out 6.8983 ActLoopCT-na noAPE APEdihe_aaaaa APEdist_aaaa APE10-dihe-na -56.05, -33.42 APE9-dihe-na -88.79, -48.0 APE8-dihe-na -71.22, -9.91 APE8-rot-na 304.05 APE67-dihe-na -61.19, -29.14 -123.36, 9.46 APE12-dist-na 1.5354 APE11-dist-na 4.8946 APE10-dist-na 5.2051 APE9-dist-na 11.4637 None None None XRAY 3.3 0.254 0.294 A 429.0 392.0 10 15 15 0 [[258, 516]] 1.0 4bwk Neurospora crassa OTHER_PAN3_NEUCR PAN3 3.4e-53 189.3 4.0 264.0 261.0 424 425 426 428 430 302 318 322 405 407 406 408.0 449 439 434 433 432 431 430 429 428 352 PAN2-PAN3 deadenylation complex subunit pan3
OTHER PAN3 PAN3_NEUCR 4BWKB Q7SDP4 235 646 656.0 AGS:1647 ATPlike Pseudo DFGin 8.0984 12.8973 None -116.7, 18.5 -139.0, 22.15 -67.02, 151.82 287.13, 999.0 73.49, -6.49 out-na out 13.8627 Saltbr-na 999.0 HRD-in -66.71, -43.56 68.66, -62.54 na-out-na SNCaoa out-na ActLoopNT-out 6.9009 ActLoopCT-na noAPE APEdihe_aaaaa APEdist_aaaa APE10-dihe-na -57.01, -33.89 APE9-dihe-na -87.36, -45.86 APE8-dihe-na -67.7, -8.98 APE8-rot-na 303.47 APE67-dihe-na -166.92, 999.0 -122.6, 109.05 APE12-dist-na 1.57 APE11-dist-na 4.9263 APE10-dist-na 5.3667 APE9-dist-na 12.4323 None None None XRAY 3.3 0.254 0.294 B 429.0 387.0 14 15 10 5 [[258, 516]] 1.0 4bwk Neurospora crassa OTHER_PAN3_NEUCR PAN3 3.4e-53 189.3 4.0 264.0 261.0 424 425 426 428 430 302 318 322 405 407 406 408.0 449 439 434 433 432 431 430 429 428 352 PAN2-PAN3 deadenylation complex subunit pan3
OTHER PAN3 PAN3_NEUCR 4BWXA Q7SDP4 234 646 656.0 AGS:1647 ATPlike Pseudo DFGin 7.9417 12.8154 None -114.92, 18.69 -139.36, 20.25 -66.2, 154.39 287.13, 999.0 71.2, -3.87 out-na out 14.696 Saltbr-na 999.0 HRD-in -65.26, -41.46 68.71, -60.85 na-out-na SNCaoa out-na ActLoopNT-out 6.8523 ActLoopCT-na noAPE APEdihe_aaaaa APEdist_aaaa APE10-dihe-na -57.52, -32.86 APE9-dihe-na -89.29, -47.03 APE8-dihe-na -70.13, -10.67 APE8-rot-na 304.73 APE67-dihe-na -61.75, -33.62 -123.15, 12.73 APE12-dist-na 1.5381 APE11-dist-na 4.8657 APE10-dist-na 5.325 APE9-dist-na 11.9168 L510M,G511P,G512M,T514G,T515A,H516R,L517F None None XRAY 2.85 0.213 0.242 A 429.0 395.0 10 15 15 0 [[258, 516]] 1.0 4bwx Neurospora crassa OTHER_PAN3_NEUCR PAN3 1.1e-59 210.5 4.0 282.0 279.0 424 425 426 428 430 302 318 322 405 407 406 408.0 449 439 434 433 432 431 430 429 428 352 PAN2-PAN3 deadenylation complex subunit pan3
OTHER PAN3 PAN3_NEUCR 4BWXB Q7SDP4 234 646 656.0 AGS:1647 ATPlike Pseudo DFGin 8.0622 12.9423 None -115.89, 18.73 -138.78, 21.11 -66.02, 153.84 287.45, 999.0 70.44, -4.24 out-na out 13.5168 Saltbr-na 999.0 HRD-in -64.84, -41.41 68.02, -61.18 na-out-na SNCaoa out-na ActLoopNT-out 6.8899 ActLoopCT-na noAPE APEdihe_aaaaa APEdist_aaaa APE10-dihe-na -59.2, -32.89 APE9-dihe-na -88.22, -46.65 APE8-dihe-na -69.2, -11.95 APE8-rot-na 305.01 APE67-dihe-na -59.96, -34.44 -124.18, 13.25 APE12-dist-na 1.54 APE11-dist-na 4.8646 APE10-dist-na 5.3607 APE9-dist-na 12.0065 L510M,G511P,G512M,T514G,T515A,H516R,L517F None None XRAY 2.85 0.213 0.242 B 429.0 397.0 6 15 15 0 [[258, 516]] 1.0 4bwx Neurospora crassa OTHER_PAN3_NEUCR PAN3 1.1e-59 210.5 4.0 282.0 279.0 424 425 426 428 430 302 318 322 405 407 406 408.0 449 439 434 433 432 431 430 429 428 352 PAN2-PAN3 deadenylation complex subunit pan3
OTHER CK2024380 A0A2I0BRS6_PLAFO 9EMYB A0A2I0BRS6 158 560 561.0 AGS:601 ATPlike Inactive None 999.0 999.0 None -145.39, 162.99 101.8, -106.02 79.77, 28.19 309.6, 22.72 -96.04, -12.33 none-na none 999.0 Saltbr-na 999.0 HRD-na- -113.49, -67.93 67.94, 26.82 na-in-in SNCaii in-in ActLoopNT-in 2.9871 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -133.17, 136.58 APE9-dihe-na 57.0, -151.54 APE8-dihe-in -86.93, 149.3 APE8-rot-na 287.05 APE67-dihe-in -64.81, -33.59 -59.14, -29.11 APE12-dist-in 12.5003 APE11-dist-in 9.9547 APE10-dist-in 6.4399 APE9-dist-in 3.564 None None None XRAY 2.814 0.245 0.286 B 413.0 379.0 33 41 41 0 [[30, 557]] 1.0 9emy Plasmodium falciparum OTHER_CK2024380_PLAFO CAMK 2.1e-05 40.5 53.0 169.0 169.0 397 398 399 401 403 0 0 0 376 378 377 379.0 0 438 433 432 431 430 429 428 427 328 non-specific serine/threonine protein kinase
OTHER CK2024380 A0A2I0BRS6_PLAFO 9EMYG A0A2I0BRS6 157 559 561.0 AGS:601 ATPlike Inactive None 999.0 999.0 None -141.12, 148.64 103.02, -106.09 77.78, 35.92 314.51, 14.85 -99.55, -19.73 none-na none 999.0 Saltbr-na 999.0 HRD-na- -114.36, -67.58 67.5, 26.88 na-in-in SNCaii in-in ActLoopNT-in 3.0012 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -133.47, 138.55 APE9-dihe-na 54.28, -150.57 APE8-dihe-in -87.01, 148.15 APE8-rot-na 293.5 APE67-dihe-in -65.24, -33.74 -57.89, -29.62 APE12-dist-in 12.4517 APE11-dist-in 9.9116 APE10-dist-in 6.3925 APE9-dist-in 3.5499 None None None XRAY 2.814 0.245 0.286 G 413.0 369.0 42 41 41 0 [[30, 557]] 1.0 9emy Plasmodium falciparum OTHER_CK2024380_PLAFO CAMK 2.1e-05 40.5 53.0 169.0 169.0 397 398 399 401 403 0 0 0 376 378 377 379.0 0 438 433 432 431 430 429 428 427 328 non-specific serine/threonine protein kinase
OTHER CK2024380 A0A2I0BRS6_PLAFO 9EMYH A0A2I0BRS6 158 560 561.0 AGS:601 ATPlike Inactive None 999.0 999.0 None -144.83, 160.67 101.1, -105.16 80.03, 28.42 309.86, 22.51 -95.63, -12.4 none-na none 999.0 Saltbr-na 999.0 HRD-na- -113.38, -68.75 67.74, 26.85 na-in-in SNCaii in-in ActLoopNT-in 2.9864 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -132.96, 137.76 APE9-dihe-na 56.9, -145.47 APE8-dihe-in -87.0, 158.51 APE8-rot-na 279.85 APE67-dihe-in -66.03, -33.57 -63.08, -32.03 APE12-dist-in 12.5339 APE11-dist-in 9.9708 APE10-dist-in 6.4221 APE9-dist-in 3.5502 None None None XRAY 2.814 0.245 0.286 H 413.0 375.0 37 41 41 0 [[30, 557]] 1.0 9emy Plasmodium falciparum OTHER_CK2024380_PLAFO CAMK 2.1e-05 40.5 53.0 169.0 169.0 397 398 399 401 403 0 0 0 376 378 377 379.0 0 438 433 432 431 430 429 428 427 328 non-specific serine/threonine protein kinase
OTHER CK2024380 A0A2I0BRS6_PLAFO 9EMYA A0A2I0BRS6 157 561 561.0 AGS:601,PE4:602 ATPlike,Allosteric Inactive None 999.0 999.0 None -141.05, 146.83 102.18, -104.97 80.11, 29.42 313.02, 18.48 -97.07, -12.64 none-na none 999.0 Saltbr-na 999.0 HRD-na- -113.81, -67.49 68.91, 22.97 na-in-in SNCaii in-in ActLoopNT-in 2.9972 ActLoopCT-in nonTYR APEdihe_aaiai APEdist_iiii APE10-dihe-na -133.3, 137.35 APE9-dihe-na 55.54, -152.24 APE8-dihe-in -84.79, 148.26 APE8-rot-na 286.36 APE67-dihe-in -66.38, -33.03 -58.56, -29.39 APE12-dist-in 12.5559 APE11-dist-in 9.9876 APE10-dist-in 6.4693 APE9-dist-in 3.566 None None None XRAY 2.814 0.245 0.286 A 413.0 370.0 43 41 41 0 [[30, 557]] 1.0 9emy Plasmodium falciparum OTHER_CK2024380_PLAFO CAMK 2.1e-05 40.5 53.0 169.0 169.0 397 398 399 401 403 0 0 0 376 378 377 379.0 0 438 433 432 431 430 429 428 427 328 non-specific serine/threonine protein kinase
CMGC PHO85 PHO85_YEAST 2PMIA P17157 19 302 305.0 AGS:3001 ATPlike Inactive DFGin 7.2372 15.7955 BLAminus -131.09, -173.7 33.09, 89.33 -97.7, 25.38 282.26, 72.33 -62.33, -32.91 in-in in 8.5936 Saltbr-in 3.4251 HRD-in -72.44, -45.76 70.96, -7.13 in-in-out SNCiio in-out ActLoopNT-in 3.1022 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_oioo APE10-dihe-na -114.99, 160.84 APE9-dihe-na -76.95, -23.6 APE8-dihe-in -133.88, 153.14 APE8-rot-out 49.79 APE67-dihe-in -62.43, -18.36 -117.43, 12.38 APE12-dist-out 6.6884 APE11-dist-in 10.4946 APE10-dist-out 8.9487 APE9-dist-out 10.5636 None None None XRAY 2.9 0.289 0.325 A 317.0 284.0 12 28 28 0 [[7, 297]] 1.0 2pmi Saccharomyces cerevisiae CMGC_PHO85_YEAST CMGC 9.7e-87 296.9 1.0 301.0 301.0 150 151 152 154 156 36 53 57 130 132 131 133.0 191 178 173 172 171 170 169 168 167 83 Cyclin-dependent protein kinase PHO85
CMGC PHO85 PHO85_YEAST 4KRCA P17157 2 302 305.0 AGS:402 ATPlike Inactive DFGin 7.4164 14.7519 BLAminus -136.61, -172.43 62.42, 59.22 -84.0, 19.74 286.1, 74.64 -64.06, -31.05 in-in in 7.9988 Saltbr-in 2.6892 HRD-in -80.52, -46.39 66.38, 2.32 in-in-out SNCiio in-out ActLoopNT-in 2.8038 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -96.44, 159.67 APE9-dihe-na 75.67, 119.42 APE8-dihe-in -55.3, 135.35 APE8-rot-out 107.93 APE67-dihe-in -57.74, -17.26 -41.11, -48.02 APE12-dist-in 13.0944 APE11-dist-in 10.8151 APE10-dist-in 6.1008 APE9-dist-in 3.0869 None None None XRAY 2.597 0.207 0.27 A 317.0 297.0 4 28 28 0 [[7, 297]] 1.0 4krc Saccharomyces cerevisiae CMGC_PHO85_YEAST CMGC 9.7e-87 296.9 1.0 301.0 301.0 150 151 152 154 156 36 53 57 130 132 131 133.0 191 178 173 172 171 170 169 168 167 83 Cyclin-dependent protein kinase PHO85
OTHER CDC7 CDC7_YEAST 7PT68 P06243 10 475 507.0 AGS:1001 ATPlike Inactive DFGin 6.5704 14.3798 ABAminus -105.18, -52.81 -73.02, 144.04 -146.73, 7.18 274.51, 95.44 -55.63, -34.23 in-in in 8.6106 Saltbr-in 2.8556 HRD-out -82.55, 76.99 -43.85, -49.64 in-in-in SNCiii in-in ActLoopNT-in 2.7548 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -61.89, 138.79 APE9-dihe-na 154.11, -158.58 APE8-dihe-in -131.43, 137.43 APE8-rot-in 301.28 APE67-dihe-inflip 83.88, -1.28 -44.87, 132.79 APE12-dist-in 9.0231 APE11-dist-in 10.8046 APE10-dist-in 4.8485 APE9-dist-in 4.6606 None None None EM 3.2 999.0 999.0 8 507.0 402.0 64 107 61 46 [[33, 469]] 1.0 7pt6 Saccharomyces cerevisiae OTHER_CDC7_YEAST CMGC 4e-17 121.0 1.0 158.0 260.0 181 182 183 185 187 76 90 94 160 162 161 163.0 301 288 283 282 281 280 279 278 277 121 Cell division control protein 7
OTHER CDC7 CDC7_YEAST 7PT6H P06243 10 475 507.0 AGS:1001 ATPlike Inactive DFGin 6.5701 14.3794 ABAminus -105.26, -52.78 -73.04, 144.07 -146.75, 7.22 274.49, 95.39 -55.64, -34.26 in-in in 8.61 Saltbr-in 2.856 HRD-out -82.58, 77.02 -43.85, -49.65 in-in-in SNCiii in-in ActLoopNT-in 2.7551 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -61.95, 138.81 APE9-dihe-na 154.08, -158.6 APE8-dihe-in -131.38, 137.47 APE8-rot-in 301.27 APE67-dihe-inflip 83.81, -1.31 -44.91, 132.85 APE12-dist-in 9.0241 APE11-dist-in 10.8052 APE10-dist-in 4.8487 APE9-dist-in 4.6608 None None None EM 3.2 999.0 999.0 H 507.0 402.0 64 107 61 46 [[33, 469]] 1.0 7pt6 Saccharomyces cerevisiae OTHER_CDC7_YEAST CMGC 4e-17 121.0 1.0 158.0 260.0 181 182 183 185 187 76 90 94 160 162 161 163.0 301 288 283 282 281 280 279 278 277 121 Cell division control protein 7
OTHER CDC7 CDC7_YEAST 7V3VH P06243 12 473 507.0 AGS:2001 ATPlike Inactive DFGin 7.406 15.0611 BLAminus -128.9, -172.48 62.33, 64.7 -96.34, 20.92 294.13, 91.42 -71.72, -23.69 in-in in 9.7148 Saltbr-in 2.9774 HRD-in -91.43, -47.78 57.88, 18.12 in-in-out SNCiio in-out ActLoopNT-in 2.927 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -143.2, 5.85 APE9-dihe-na -75.12, -172.29 APE8-dihe-in -97.45, 157.79 APE8-rot-out 187.23 APE67-dihe-inflip 88.73, -6.04 -67.06, 131.23 APE12-dist-in 9.828 APE11-dist-in 11.6406 APE10-dist-in 5.8595 APE9-dist-in 3.5117 None None None EM 2.9 999.0 999.0 H 507.0 381.0 81 107 45 62 [[33, 469]] 1.0 7v3v Saccharomyces cerevisiae OTHER_CDC7_YEAST CMGC 4e-17 121.0 1.0 158.0 260.0 181 182 183 185 187 76 90 94 160 162 161 163.0 301 288 283 282 281 280 279 278 277 121 Cell division control protein 7