Ligand: A1AHE

Total number of chains: 14
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 14 100.0% 9AXXA
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 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
STE MAP2K1 MP2K1_HUMAN 9AXMC Q02750 43 376 393.0 A1AHE:60401 Type1 Inactive DFGin 6.668 14.1318 BLBplus -150.29, 169.67 59.1, 61.29 -116.51, 166.39 40.92, 86.38 -72.68, 94.97 out-none out 15.3794 Saltbr-none 999.0 HRD-in -102.21, -42.14 67.4, -10.68 none-out-out SNCnoo out-out ActLoopNT-out 9.7501 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -64.72, 121.05 APE9-dihe-na -67.96, 179.71 APE8-dihe-out -110.15, -27.15 APE8-rot-out 56.89 APE67-dihe-out -127.4, 134.54 -138.28, 164.48 APE12-dist-out 17.1619 APE11-dist-out 22.1776 APE10-dist-out 24.2389 APE9-dist-out 13.2396 S218A,S222A None None XRAY 2.42 0.263 0.301 C 310.0 290.0 0 26 26 0 [[68, 361]] 1.0 9axm STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AXHA Q02750 39 381 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.113 14.2053 BLBplus -138.52, 176.84 56.32, 45.26 -98.43, 166.79 48.45, 76.71 -79.29, 73.17 out-out out 15.3891 Saltbr-out 15.4608 HRD-in -79.27, -55.22 75.38, 2.3 out-out-out SNCooo out-out ActLoopNT-out 9.3908 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -141.27, 126.74 APE9-dihe-na -91.23, -150.48 APE8-dihe-out -108.84, -16.83 APE8-rot-out 178.7 APE67-dihe-out -130.79, 128.8 -115.86, 151.78 APE12-dist-out 17.4166 APE11-dist-out 17.6237 APE10-dist-out 20.8985 APE9-dist-out 13.1543 None None None XRAY 2.81 0.206 0.253 A 310.0 299.0 0 26 26 0 [[68, 361]] 1.0 9axh STE_MAP2K1_HUMAN STE 1.5e-98 335.3 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 9AXHB Q02750 38 381 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.0283 13.959 BLBplus -143.4, 172.79 59.61, 49.11 -104.03, 163.1 47.48, 79.51 -74.37, 70.81 out-out out 15.4154 Saltbr-out 14.8168 HRD-in -76.49, -58.47 81.39, -4.23 out-out-out SNCooo out-out ActLoopNT-out 9.3218 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -140.95, 129.53 APE9-dihe-na -95.7, -172.17 APE8-dihe-out -83.87, -23.26 APE8-rot-out 67.32 APE67-dihe-out -134.03, 129.22 -119.03, 156.34 APE12-dist-out 17.3071 APE11-dist-out 17.5745 APE10-dist-out 20.8998 APE9-dist-out 12.718 None None None XRAY 2.81 0.206 0.253 B 310.0 300.0 0 26 26 0 [[68, 361]] 1.0 9axh STE_MAP2K1_HUMAN STE 1.5e-98 335.3 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 9AXMA Q02750 38 382 393.0 A1AHE:60401,ANP:60403 Type1,ATPlike Inactive DFGin 6.2039 13.9992 BLBplus -146.84, 170.95 57.84, 58.3 -113.46, 158.4 47.1, 81.42 -71.93, 78.64 out-out out 15.4263 Saltbr-out 15.5133 HRD-in -80.25, -54.29 71.05, 3.5 out-out-out SNCooo out-out ActLoopNT-out 9.1102 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -58.81, 135.38 APE9-dihe-na -86.44, -174.93 APE8-dihe-out -114.7, -19.48 APE8-rot-out 61.33 APE67-dihe-out -156.42, 133.96 -137.25, 175.14 APE12-dist-out 17.3471 APE11-dist-out 22.1228 APE10-dist-out 24.2234 APE9-dist-out 13.2409 S218A,S222A None None XRAY 2.42 0.263 0.301 A 310.0 301.0 0 26 26 0 [[68, 361]] 1.0 9axm STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AXXA Q02750 41 382 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.1565 14.4729 BLBplus -142.21, 167.57 61.94, 40.19 -92.82, 170.58 38.95, 89.02 -82.21, 74.48 out-out out 15.9248 Saltbr-out 15.6608 HRD-in -77.34, -56.94 85.02, -11.71 out-out-out SNCooo out-out ActLoopNT-out 9.6225 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -70.01, 140.02 APE9-dihe-na -107.63, 178.58 APE8-dihe-out -103.64, -13.88 APE8-rot-out 56.98 APE67-dihe-out -152.18, 145.48 -132.34, 175.09 APE12-dist-out 18.633 APE11-dist-out 16.0857 APE10-dist-out 21.091 APE9-dist-out 12.7711 S218A,S222A None None XRAY 2.07 0.215 0.248 A 310.0 298.0 0 26 26 0 [[68, 361]] 1.0 9axx STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AXXC Q02750 37 378 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.0661 14.2508 BLBplus -153.34, 165.37 62.85, 41.08 -93.54, 164.6 44.67, 86.41 -75.31, 71.49 out-out out 15.5167 Saltbr-out 15.0221 HRD-in -80.68, -38.87 53.15, 7.3 out-out-out SNCooo out-out ActLoopNT-out 9.6912 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -68.91, 127.09 APE9-dihe-na -100.27, 169.31 APE8-dihe-out -98.12, -23.61 APE8-rot-out 61.42 APE67-dihe-out -153.77, 146.66 -125.41, 178.29 APE12-dist-out 18.4501 APE11-dist-out 16.1193 APE10-dist-out 21.5812 APE9-dist-out 12.7488 S218A,S222A None None XRAY 2.07 0.215 0.248 C 310.0 297.0 1 26 26 0 [[68, 361]] 1.0 9axx STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AYAB Q02750 42 382 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.2091 14.117 BLBplus -156.4, 169.03 57.59, 47.08 -100.39, 159.82 46.95, 83.0 -73.48, 80.99 out-out out 15.4442 Saltbr-out 14.9574 HRD-in -72.22, -50.64 78.5, -7.92 out-out-out SNCooo out-out ActLoopNT-out 9.725 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -67.32, 133.53 APE9-dihe-na -94.07, -169.54 APE8-dihe-out -110.54, -56.8 APE8-rot-out 71.18 APE67-dihe-out -155.6, 139.89 -98.61, 175.74 APE12-dist-out 17.2211 APE11-dist-out 22.1488 APE10-dist-out 24.1945 APE9-dist-out 13.7662 S218A,S222A None None XRAY 2.59 0.214 0.257 B 310.0 297.0 0 26 26 0 [[68, 361]] 1.0 9aya STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AYAD Q02750 39 382 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.236 14.1136 BLBplus -150.42, 169.48 62.14, 35.37 -84.74, 166.85 39.42, 88.37 -83.08, 73.44 out-out out 15.3824 Saltbr-out 15.2874 HRD-in -84.82, -56.5 86.5, -11.08 out-out-out SNCooo out-out ActLoopNT-out 9.653 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 132.69 APE8-dihe-out -103.38, -24.48 APE8-rot-out 47.89 APE67-dihe-out -161.23, 135.82 -100.94, -174.52 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 12.7487 S218A,S222A None None XRAY 2.59 0.214 0.257 D 310.0 293.0 7 26 23 3 [[68, 361]] 1.0 9aya STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AY7B Q02750 33 383 393.0 A1AHE:401,ANP:402 Type1,ATPlike Inactive DFGin 6.1312 14.2675 BLBplus -154.96, 169.08 61.0, 36.72 -91.6, 162.02 49.73, 81.71 -77.61, 77.19 out-out out 15.5132 Saltbr-out 15.4022 HRD-in -75.89, -55.94 83.29, -11.88 out-out-out SNCooo out-out ActLoopNT-out 9.5756 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -66.62, 136.57 APE9-dihe-na -89.93, -175.43 APE8-dihe-out -113.57, -10.62 APE8-rot-out 51.26 APE67-dihe-out -146.5, 144.85 -157.42, 170.13 APE12-dist-out 17.3436 APE11-dist-out 22.1142 APE10-dist-out 24.2068 APE9-dist-out 13.7295 S218A,S222A None None XRAY 2.41 0.203 0.236 B 394.0 322.0 29 26 26 0 [[68, 361]] 1.0 9ay7 STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXAB Q02750 52 380 393.0 A1AHE:401 Type3 Inactive DFGin 6.8129 13.7682 BLBplus -157.46, 170.37 59.28, 64.98 -117.48, 165.11 40.29, 81.19 -81.1, 74.19 out-out out 15.4311 Saltbr-out 17.4099 HRD-in -75.24, -42.64 72.38, -11.77 out-out-out SNCooo out-out ActLoopNT-out 9.2081 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -68.37, -62.71 APE9-dihe-na 103.09, 102.94 APE8-dihe-out -88.38, -48.33 APE8-rot-out 62.02 APE67-dihe-out -122.1, 131.17 -98.78, 143.35 APE12-dist-out 16.6961 APE11-dist-out 18.1264 APE10-dist-out 22.8521 APE9-dist-out 12.4243 S218A,S222A None None EM 4.36 999.0 999.0 B 394.0 278.0 51 26 26 0 [[68, 361]] 1.0 9axa STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXAD Q02750 59 383 393.0 A1AHE:401 Type3 Inactive DFGin 6.1878 15.038 BLBplus -161.59, 167.64 63.71, 27.36 -77.56, 162.55 63.45, 90.49 -80.72, 76.54 out-out out 17.6128 Saltbr-out 18.7979 HRD-in -103.62, -49.66 71.76, -9.27 out-out-out SNCooo out-out ActLoopNT-out 9.7971 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na 56.39, -81.94 APE9-dihe-na 48.87, 69.85 APE8-dihe-out -71.23, -18.7 APE8-rot-out 181.91 APE67-dihe-out -127.48, 156.86 -129.99, 139.21 APE12-dist-out 19.1615 APE11-dist-out 16.676 APE10-dist-out 21.3744 APE9-dist-out 12.2717 S218A,S222A None None EM 4.36 999.0 999.0 D 394.0 275.0 50 26 26 0 [[68, 361]] 1.0 9axa STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXCB Q02750 52 380 393.0 A1AHE:401 Type3 Inactive DFGin 5.9787 13.8572 BLBplus -156.34, 159.86 58.05, 51.28 -90.68, 168.57 45.43, 79.18 -80.79, 77.37 out-out out 15.5246 Saltbr-out 16.4826 HRD-in -82.47, -42.11 70.94, -10.4 out-out-out SNCooo out-out ActLoopNT-out 9.4447 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -71.13, -44.57 APE9-dihe-na 100.23, 100.79 APE8-dihe-out -96.55, -49.37 APE8-rot-out 61.77 APE67-dihe-out -125.36, 134.49 -112.13, 139.3 APE12-dist-out 16.7317 APE11-dist-out 18.0625 APE10-dist-out 22.9269 APE9-dist-out 12.6232 S218A,S222A None None EM 4.16 999.0 999.0 B 394.0 278.0 51 26 26 0 [[68, 361]] 1.0 9axc STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXCD Q02750 59 383 393.0 A1AHE:401 Type3 Inactive DFGin 5.9443 14.9428 BLBplus -155.71, -173.77 60.85, 40.35 -100.84, 165.38 63.0, 90.55 -83.19, 80.54 out-out out 17.464 Saltbr-out 19.8823 HRD-in -94.68, -47.55 72.62, -11.59 out-out-out SNCooo out-out ActLoopNT-out 9.3746 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na 51.94, -88.31 APE9-dihe-na 51.11, 70.23 APE8-dihe-out -66.0, -35.69 APE8-rot-in 292.49 APE67-dihe-out -158.48, 126.03 -105.47, -179.54 APE12-dist-out 18.7745 APE11-dist-out 17.0622 APE10-dist-out 21.141 APE9-dist-out 12.4403 S218A,S222A None None EM 4.16 999.0 999.0 D 394.0 275.0 50 26 26 0 [[68, 361]] 1.0 9axc STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXYB Q02750 40 383 393.0 A1AHE:401,ANP:402 Type3,ATPlike Inactive DFGin 5.9383 14.1345 BLBplus -149.11, 165.49 51.9, 40.29 -92.3, 159.5 54.58, 76.32 -75.9, 70.87 out-out out 15.3992 Saltbr-out 14.9875 HRD-in -57.0, -47.47 79.88, -10.87 out-out-out SNCooo out-out ActLoopNT-out 9.3372 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -115.09, 128.49 APE9-dihe-na -79.18, 173.05 APE8-dihe-out -111.11, -19.81 APE8-rot-out 47.95 APE67-dihe-out -148.5, 141.81 -130.51, 175.5 APE12-dist-out 18.1758 APE11-dist-out 19.7311 APE10-dist-out 22.7854 APE9-dist-out 13.2287 S218A,S222A None None XRAY 3.6 0.19 0.237 B 394.0 312.0 32 26 26 0 [[68, 361]] 1.0 9axy STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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

Ligand: A1AHE

Total number of chains: 14
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 14 100.0% 9AXXA
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
STE MAP2K1 MP2K1_HUMAN 9AXMC Q02750 43 376 393.0 A1AHE:60401 Type1 Inactive DFGin 6.668 14.1318 BLBplus -150.29, 169.67 59.1, 61.29 -116.51, 166.39 40.92, 86.38 -72.68, 94.97 out-none out 15.3794 Saltbr-none 999.0 HRD-in -102.21, -42.14 67.4, -10.68 none-out-out SNCnoo out-out ActLoopNT-out 9.7501 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -64.72, 121.05 APE9-dihe-na -67.96, 179.71 APE8-dihe-out -110.15, -27.15 APE8-rot-out 56.89 APE67-dihe-out -127.4, 134.54 -138.28, 164.48 APE12-dist-out 17.1619 APE11-dist-out 22.1776 APE10-dist-out 24.2389 APE9-dist-out 13.2396 S218A,S222A None None XRAY 2.42 0.263 0.301 C 310.0 290.0 0 26 26 0 [[68, 361]] 1.0 9axm Homo sapiens STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AXHA Q02750 39 381 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.113 14.2053 BLBplus -138.52, 176.84 56.32, 45.26 -98.43, 166.79 48.45, 76.71 -79.29, 73.17 out-out out 15.3891 Saltbr-out 15.4608 HRD-in -79.27, -55.22 75.38, 2.3 out-out-out SNCooo out-out ActLoopNT-out 9.3908 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -141.27, 126.74 APE9-dihe-na -91.23, -150.48 APE8-dihe-out -108.84, -16.83 APE8-rot-out 178.7 APE67-dihe-out -130.79, 128.8 -115.86, 151.78 APE12-dist-out 17.4166 APE11-dist-out 17.6237 APE10-dist-out 20.8985 APE9-dist-out 13.1543 None None None XRAY 2.81 0.206 0.253 A 310.0 299.0 0 26 26 0 [[68, 361]] 1.0 9axh Homo sapiens STE_MAP2K1_HUMAN STE 1.5e-98 335.3 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 9AXHB Q02750 38 381 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.0283 13.959 BLBplus -143.4, 172.79 59.61, 49.11 -104.03, 163.1 47.48, 79.51 -74.37, 70.81 out-out out 15.4154 Saltbr-out 14.8168 HRD-in -76.49, -58.47 81.39, -4.23 out-out-out SNCooo out-out ActLoopNT-out 9.3218 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -140.95, 129.53 APE9-dihe-na -95.7, -172.17 APE8-dihe-out -83.87, -23.26 APE8-rot-out 67.32 APE67-dihe-out -134.03, 129.22 -119.03, 156.34 APE12-dist-out 17.3071 APE11-dist-out 17.5745 APE10-dist-out 20.8998 APE9-dist-out 12.718 None None None XRAY 2.81 0.206 0.253 B 310.0 300.0 0 26 26 0 [[68, 361]] 1.0 9axh Homo sapiens STE_MAP2K1_HUMAN STE 1.5e-98 335.3 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 9AXMA Q02750 38 382 393.0 A1AHE:60401,ANP:60403 Type1,ATPlike Inactive DFGin 6.2039 13.9992 BLBplus -146.84, 170.95 57.84, 58.3 -113.46, 158.4 47.1, 81.42 -71.93, 78.64 out-out out 15.4263 Saltbr-out 15.5133 HRD-in -80.25, -54.29 71.05, 3.5 out-out-out SNCooo out-out ActLoopNT-out 9.1102 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -58.81, 135.38 APE9-dihe-na -86.44, -174.93 APE8-dihe-out -114.7, -19.48 APE8-rot-out 61.33 APE67-dihe-out -156.42, 133.96 -137.25, 175.14 APE12-dist-out 17.3471 APE11-dist-out 22.1228 APE10-dist-out 24.2234 APE9-dist-out 13.2409 S218A,S222A None None XRAY 2.42 0.263 0.301 A 310.0 301.0 0 26 26 0 [[68, 361]] 1.0 9axm Homo sapiens STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AXXA Q02750 41 382 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.1565 14.4729 BLBplus -142.21, 167.57 61.94, 40.19 -92.82, 170.58 38.95, 89.02 -82.21, 74.48 out-out out 15.9248 Saltbr-out 15.6608 HRD-in -77.34, -56.94 85.02, -11.71 out-out-out SNCooo out-out ActLoopNT-out 9.6225 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -70.01, 140.02 APE9-dihe-na -107.63, 178.58 APE8-dihe-out -103.64, -13.88 APE8-rot-out 56.98 APE67-dihe-out -152.18, 145.48 -132.34, 175.09 APE12-dist-out 18.633 APE11-dist-out 16.0857 APE10-dist-out 21.091 APE9-dist-out 12.7711 S218A,S222A None None XRAY 2.07 0.215 0.248 A 310.0 298.0 0 26 26 0 [[68, 361]] 1.0 9axx Homo sapiens STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AXXC Q02750 37 378 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.0661 14.2508 BLBplus -153.34, 165.37 62.85, 41.08 -93.54, 164.6 44.67, 86.41 -75.31, 71.49 out-out out 15.5167 Saltbr-out 15.0221 HRD-in -80.68, -38.87 53.15, 7.3 out-out-out SNCooo out-out ActLoopNT-out 9.6912 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -68.91, 127.09 APE9-dihe-na -100.27, 169.31 APE8-dihe-out -98.12, -23.61 APE8-rot-out 61.42 APE67-dihe-out -153.77, 146.66 -125.41, 178.29 APE12-dist-out 18.4501 APE11-dist-out 16.1193 APE10-dist-out 21.5812 APE9-dist-out 12.7488 S218A,S222A None None XRAY 2.07 0.215 0.248 C 310.0 297.0 1 26 26 0 [[68, 361]] 1.0 9axx Homo sapiens STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AYAB Q02750 42 382 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.2091 14.117 BLBplus -156.4, 169.03 57.59, 47.08 -100.39, 159.82 46.95, 83.0 -73.48, 80.99 out-out out 15.4442 Saltbr-out 14.9574 HRD-in -72.22, -50.64 78.5, -7.92 out-out-out SNCooo out-out ActLoopNT-out 9.725 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -67.32, 133.53 APE9-dihe-na -94.07, -169.54 APE8-dihe-out -110.54, -56.8 APE8-rot-out 71.18 APE67-dihe-out -155.6, 139.89 -98.61, 175.74 APE12-dist-out 17.2211 APE11-dist-out 22.1488 APE10-dist-out 24.1945 APE9-dist-out 13.7662 S218A,S222A None None XRAY 2.59 0.214 0.257 B 310.0 297.0 0 26 26 0 [[68, 361]] 1.0 9aya Homo sapiens STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AYAD Q02750 39 382 393.0 A1AHE:60401,ANP:60402 Type1,ATPlike Inactive DFGin 6.236 14.1136 BLBplus -150.42, 169.48 62.14, 35.37 -84.74, 166.85 39.42, 88.37 -83.08, 73.44 out-out out 15.3824 Saltbr-out 15.2874 HRD-in -84.82, -56.5 86.5, -11.08 out-out-out SNCooo out-out ActLoopNT-out 9.653 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 132.69 APE8-dihe-out -103.38, -24.48 APE8-rot-out 47.89 APE67-dihe-out -161.23, 135.82 -100.94, -174.52 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 12.7487 S218A,S222A None None XRAY 2.59 0.214 0.257 D 310.0 293.0 7 26 23 3 [[68, 361]] 1.0 9aya Homo sapiens STE_MAP2K1_HUMAN STE 6.5e-98 333.1 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 9AY7B Q02750 33 383 393.0 A1AHE:401,ANP:402 Type1,ATPlike Inactive DFGin 6.1312 14.2675 BLBplus -154.96, 169.08 61.0, 36.72 -91.6, 162.02 49.73, 81.71 -77.61, 77.19 out-out out 15.5132 Saltbr-out 15.4022 HRD-in -75.89, -55.94 83.29, -11.88 out-out-out SNCooo out-out ActLoopNT-out 9.5756 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -66.62, 136.57 APE9-dihe-na -89.93, -175.43 APE8-dihe-out -113.57, -10.62 APE8-rot-out 51.26 APE67-dihe-out -146.5, 144.85 -157.42, 170.13 APE12-dist-out 17.3436 APE11-dist-out 22.1142 APE10-dist-out 24.2068 APE9-dist-out 13.7295 S218A,S222A None None XRAY 2.41 0.203 0.236 B 394.0 322.0 29 26 26 0 [[68, 361]] 1.0 9ay7 Homo sapiens STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXAB Q02750 52 380 393.0 A1AHE:401 Type3 Inactive DFGin 6.8129 13.7682 BLBplus -157.46, 170.37 59.28, 64.98 -117.48, 165.11 40.29, 81.19 -81.1, 74.19 out-out out 15.4311 Saltbr-out 17.4099 HRD-in -75.24, -42.64 72.38, -11.77 out-out-out SNCooo out-out ActLoopNT-out 9.2081 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -68.37, -62.71 APE9-dihe-na 103.09, 102.94 APE8-dihe-out -88.38, -48.33 APE8-rot-out 62.02 APE67-dihe-out -122.1, 131.17 -98.78, 143.35 APE12-dist-out 16.6961 APE11-dist-out 18.1264 APE10-dist-out 22.8521 APE9-dist-out 12.4243 S218A,S222A None None EM 4.36 999.0 999.0 B 394.0 278.0 51 26 26 0 [[68, 361]] 1.0 9axa Homo sapiens STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXAD Q02750 59 383 393.0 A1AHE:401 Type3 Inactive DFGin 6.1878 15.038 BLBplus -161.59, 167.64 63.71, 27.36 -77.56, 162.55 63.45, 90.49 -80.72, 76.54 out-out out 17.6128 Saltbr-out 18.7979 HRD-in -103.62, -49.66 71.76, -9.27 out-out-out SNCooo out-out ActLoopNT-out 9.7971 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na 56.39, -81.94 APE9-dihe-na 48.87, 69.85 APE8-dihe-out -71.23, -18.7 APE8-rot-out 181.91 APE67-dihe-out -127.48, 156.86 -129.99, 139.21 APE12-dist-out 19.1615 APE11-dist-out 16.676 APE10-dist-out 21.3744 APE9-dist-out 12.2717 S218A,S222A None None EM 4.36 999.0 999.0 D 394.0 275.0 50 26 26 0 [[68, 361]] 1.0 9axa Homo sapiens STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXCB Q02750 52 380 393.0 A1AHE:401 Type3 Inactive DFGin 5.9787 13.8572 BLBplus -156.34, 159.86 58.05, 51.28 -90.68, 168.57 45.43, 79.18 -80.79, 77.37 out-out out 15.5246 Saltbr-out 16.4826 HRD-in -82.47, -42.11 70.94, -10.4 out-out-out SNCooo out-out ActLoopNT-out 9.4447 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -71.13, -44.57 APE9-dihe-na 100.23, 100.79 APE8-dihe-out -96.55, -49.37 APE8-rot-out 61.77 APE67-dihe-out -125.36, 134.49 -112.13, 139.3 APE12-dist-out 16.7317 APE11-dist-out 18.0625 APE10-dist-out 22.9269 APE9-dist-out 12.6232 S218A,S222A None None EM 4.16 999.0 999.0 B 394.0 278.0 51 26 26 0 [[68, 361]] 1.0 9axc Homo sapiens STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXCD Q02750 59 383 393.0 A1AHE:401 Type3 Inactive DFGin 5.9443 14.9428 BLBplus -155.71, -173.77 60.85, 40.35 -100.84, 165.38 63.0, 90.55 -83.19, 80.54 out-out out 17.464 Saltbr-out 19.8823 HRD-in -94.68, -47.55 72.62, -11.59 out-out-out SNCooo out-out ActLoopNT-out 9.3746 ActLoopCT-out nonTYR APEdihe_aaoio APEdist_oooo APE10-dihe-na 51.94, -88.31 APE9-dihe-na 51.11, 70.23 APE8-dihe-out -66.0, -35.69 APE8-rot-in 292.49 APE67-dihe-out -158.48, 126.03 -105.47, -179.54 APE12-dist-out 18.7745 APE11-dist-out 17.0622 APE10-dist-out 21.141 APE9-dist-out 12.4403 S218A,S222A None None EM 4.16 999.0 999.0 D 394.0 275.0 50 26 26 0 [[68, 361]] 1.0 9axc Homo sapiens STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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 9AXYB Q02750 40 383 393.0 A1AHE:401,ANP:402 Type3,ATPlike Inactive DFGin 5.9383 14.1345 BLBplus -149.11, 165.49 51.9, 40.29 -92.3, 159.5 54.58, 76.32 -75.9, 70.87 out-out out 15.3992 Saltbr-out 14.9875 HRD-in -57.0, -47.47 79.88, -10.87 out-out-out SNCooo out-out ActLoopNT-out 9.3372 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -115.09, 128.49 APE9-dihe-na -79.18, 173.05 APE8-dihe-out -111.11, -19.81 APE8-rot-out 47.95 APE67-dihe-out -148.5, 141.81 -130.51, 175.5 APE12-dist-out 18.1758 APE11-dist-out 19.7311 APE10-dist-out 22.7854 APE9-dist-out 13.2287 S218A,S222A None None XRAY 3.6 0.19 0.237 B 394.0 312.0 32 26 26 0 [[68, 361]] 1.0 9axy Homo sapiens STE_MAP2K1_HUMAN STE 1.1e-96 329.3 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

Ligand: A1AHE

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
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 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