Ligand: LCJ

Total number of chains: 11
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 8 72.7% 6PP9B
None None 3 27.3% 6Q0JC

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 8DGSB Q02750 38 383 393.0 AGS:60801,LCJ:60803 ATPlike,Type1 Inactive DFGin 6.249 12.997 BLBplus -155.73, -179.02 61.68, 27.26 -72.39, 155.67 44.5, 85.53 -87.2, 64.42 out-out out 16.295 Saltbr-out 16.06 HRD-in -62.57, -46.0 64.99, -4.53 out-out-out SNCooo out-out ActLoopNT-out 8.709 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 17.111 APE11-dist-out 20.577 APE10-dist-out 22.919 APE9-dist-out 13.271 S218A,S222A None None EM 4.3 999.0 999.0 B 414 314 32 0 0 0 [[68, 361]] 1.0 8dgs STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6PP9B Q02750 38 383 393.0 ANP:801,LCJ:803 ATPlike,Type3 Inactive DFGin 6.051 13.85 BLBplus -152.52, 171.62 57.53, 41.01 -92.48, 164.33 45.1, 87.01 -81.4, 67.83 out-out out 15.469 Saltbr-out 15.325 HRD-in -69.19, -57.7 73.02, -1.06 out-out-out SNCooo out-out ActLoopNT-out 8.325 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -150.75, 155.46 APE9-dihe-na -104.35, -179.3 APE8-dihe-out -103.86, -21.71 APE8-rot-out 60.0 APE67-dihe-out -161.36, 138.21 -120.01, -175.99 APE12-dist-out 17.629 APE11-dist-out 18.098 APE10-dist-out 21.191 APE9-dist-out 12.184 S218A,S222A None None XRAY 2.59 0.222 0.245 B 397 314 32 0 0 0 [[68, 361]] 1.0 6pp9 STE_MAP2K1_HUMAN STE 1.1e-96 329.2 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 5.968 13.536 BLBplus -152.99, 179.37 55.42, 45.61 -100.12, 157.06 44.99, 96.32 -80.94, 77.56 out-out out 15.569 Saltbr-out 15.733 HRD-in -64.15, -51.45 68.84, -11.98 out-out-out SNCooo out-out ActLoopNT-out 8.945 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 16.674 APE11-dist-out 21.627 APE10-dist-out 23.285 APE9-dist-out 13.705 S218A,S222A None None EM 3.9 999.0 999.0 B 414 311 32 0 0 0 [[68, 361]] 1.0 8dgt STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6NYBB Q02750 56 383 393.0 ADP:60601,LCJ:60901 ATPlike,Type3 Inactive DFGin 5.959 14.037 BLBplus -152.28, 170.52 57.47, 42.76 -92.93, 161.49 47.46, 85.53 -88.41, 68.49 out-out out 15.47 Saltbr-out 17.602 HRD-in -56.15, -54.04 65.39, 11.35 out-out-out SNCooo out-out ActLoopNT-out 8.292 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -140.81, 127.27 APE9-dihe-na -93.66, 157.79 APE8-dihe-out -110.82, -26.16 APE8-rot-out 55.56 APE67-dihe-out -130.29, 148.43 -119.13, 133.87 APE12-dist-out 17.78 APE11-dist-out 18.319 APE10-dist-out 22.379 APE9-dist-out 12.159 S218A,S222A None None EM 4.1 999.0 999.0 B 415 289 39 0 0 0 [[68, 361]] 1.0 6nyb STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 6.494 13.701 BLBplus -142.17, 163.3 59.56, 65.37 -113.14, 157.69 39.56, 95.33 -79.99, 73.26 out-out out 15.756 Saltbr-out 16.332 HRD-in -69.63, -60.91 71.6, -9.27 out-out-out SNCooo out-out ActLoopNT-out 8.001 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 17.227 APE11-dist-out 22.241 APE10-dist-out 24.396 APE9-dist-out 13.769 S218A,S222A None None EM 3.4 999.0 999.0 B 415 279 40 0 0 0 [[68, 361]] 1.0 9mmp STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 6.675 13.489 BLBplus -138.6, 170.41 60.57, 44.79 -97.28, 158.99 35.24, 93.11 -75.64, 83.14 out-out out 15.421 Saltbr-out 15.635 HRD-in -61.2, -52.92 69.79, -9.3 out-out-out SNCooo out-out ActLoopNT-out 9.01 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 17.266 APE11-dist-out 22.093 APE10-dist-out 24.077 APE9-dist-out 13.54 S218A,S222A None None EM 2.9 999.0 999.0 B 415 279 40 0 0 0 [[68, 361]] 1.0 9mmq STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 13.545 BLBplus -144.47, 166.22 62.86, 45.64 -102.79, 155.22 38.56, 95.23 -78.03, 72.6 out-out out 15.325 Saltbr-out 15.734 HRD-in -59.38, -50.94 68.52, -2.49 out-out-out SNCooo out-out ActLoopNT-out 8.952 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 17.035 APE11-dist-out 22.006 APE10-dist-out 24.031 APE9-dist-out 13.58 S218A,S222A None None EM 3.9 999.0 999.0 B 415 279 40 0 0 0 [[68, 361]] 1.0 9mmr STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 6.855 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 15.408 Saltbr-out 15.769 HRD-in -66.2, -52.71 70.98, -11.79 out-out-out SNCooo out-out ActLoopNT-out 8.857 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 17.282 APE11-dist-out 22.217 APE10-dist-out 24.353 APE9-dist-out 13.675 S218A,S222A None None EM 3.3 999.0 999.0 B 415 278 40 0 0 0 [[68, 361]] 1.0 9mms STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 15.498 Saltbr-none 999.0 HRD-in -63.91, -56.51 90.24, -35.06 none-out-out SNCnoo out-out ActLoopNT-out 9.29 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 17.155 APE11-dist-out 21.652 APE10-dist-out 23.797 APE9-dist-out 13.499 S218A,S222A None None EM 5.7 999.0 999.0 C 414 306 31 0 0 0 [[68, 361]] 1.0 6q0t STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 15.498 Saltbr-none 999.0 HRD-in -63.96, -56.51 90.23, -35.02 none-out-out SNCnoo out-out ActLoopNT-out 9.29 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 17.156 APE11-dist-out 21.653 APE10-dist-out 23.798 APE9-dist-out 13.498 S218A,S222A None None EM 4.9 999.0 999.0 C 415 306 31 0 0 0 [[68, 361]] 1.0 6q0j STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 15.498 Saltbr-none 999.0 HRD-in -63.9, -56.54 90.23, -35.02 none-out-out SNCnoo out-out ActLoopNT-out 9.289 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 17.156 APE11-dist-out 21.654 APE10-dist-out 23.798 APE9-dist-out 13.499 S218A,S222A None None EM 4.9 999.0 999.0 D 415 306 31 0 0 0 [[68, 361]] 1.0 6q0j STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1

Ligand: LCJ

Total number of chains: 11
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 8 72.7% 6PP9B
None None 3 27.3% 6Q0JC

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 8DGSB Q02750 38 383 393.0 AGS:60801,LCJ:60803 ATPlike,Type1 Inactive DFGin 6.249 12.997 BLBplus -155.73, -179.02 61.68, 27.26 -72.39, 155.67 44.5, 85.53 -87.2, 64.42 out-out out 16.295 Saltbr-out 16.06 HRD-in -62.57, -46.0 64.99, -4.53 out-out-out SNCooo out-out ActLoopNT-out 8.709 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 17.111 APE11-dist-out 20.577 APE10-dist-out 22.919 APE9-dist-out 13.271 S218A,S222A None None EM 4.3 999.0 999.0 B 414 314 32 0 0 0 [[68, 361]] 1.0 8dgs Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6PP9B Q02750 38 383 393.0 ANP:801,LCJ:803 ATPlike,Type3 Inactive DFGin 6.051 13.85 BLBplus -152.52, 171.62 57.53, 41.01 -92.48, 164.33 45.1, 87.01 -81.4, 67.83 out-out out 15.469 Saltbr-out 15.325 HRD-in -69.19, -57.7 73.02, -1.06 out-out-out SNCooo out-out ActLoopNT-out 8.325 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -150.75, 155.46 APE9-dihe-na -104.35, -179.3 APE8-dihe-out -103.86, -21.71 APE8-rot-out 60.0 APE67-dihe-out -161.36, 138.21 -120.01, -175.99 APE12-dist-out 17.629 APE11-dist-out 18.098 APE10-dist-out 21.191 APE9-dist-out 12.184 S218A,S222A None None XRAY 2.59 0.222 0.245 B 397 314 32 0 0 0 [[68, 361]] 1.0 6pp9 Homo sapiens STE_MAP2K1_HUMAN STE 1.1e-96 329.2 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 5.968 13.536 BLBplus -152.99, 179.37 55.42, 45.61 -100.12, 157.06 44.99, 96.32 -80.94, 77.56 out-out out 15.569 Saltbr-out 15.733 HRD-in -64.15, -51.45 68.84, -11.98 out-out-out SNCooo out-out ActLoopNT-out 8.945 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 16.674 APE11-dist-out 21.627 APE10-dist-out 23.285 APE9-dist-out 13.705 S218A,S222A None None EM 3.9 999.0 999.0 B 414 311 32 0 0 0 [[68, 361]] 1.0 8dgt Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1
STE MAP2K1 MP2K1_HUMAN 6NYBB Q02750 56 383 393.0 ADP:60601,LCJ:60901 ATPlike,Type3 Inactive DFGin 5.959 14.037 BLBplus -152.28, 170.52 57.47, 42.76 -92.93, 161.49 47.46, 85.53 -88.41, 68.49 out-out out 15.47 Saltbr-out 17.602 HRD-in -56.15, -54.04 65.39, 11.35 out-out-out SNCooo out-out ActLoopNT-out 8.292 ActLoopCT-out nonTYR APEdihe_aaooo APEdist_oooo APE10-dihe-na -140.81, 127.27 APE9-dihe-na -93.66, 157.79 APE8-dihe-out -110.82, -26.16 APE8-rot-out 55.56 APE67-dihe-out -130.29, 148.43 -119.13, 133.87 APE12-dist-out 17.78 APE11-dist-out 18.319 APE10-dist-out 22.379 APE9-dist-out 12.159 S218A,S222A None None EM 4.1 999.0 999.0 B 415 289 39 0 0 0 [[68, 361]] 1.0 6nyb Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 6.494 13.701 BLBplus -142.17, 163.3 59.56, 65.37 -113.14, 157.69 39.56, 95.33 -79.99, 73.26 out-out out 15.756 Saltbr-out 16.332 HRD-in -69.63, -60.91 71.6, -9.27 out-out-out SNCooo out-out ActLoopNT-out 8.001 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 17.227 APE11-dist-out 22.241 APE10-dist-out 24.396 APE9-dist-out 13.769 S218A,S222A None None EM 3.4 999.0 999.0 B 415 279 40 0 0 0 [[68, 361]] 1.0 9mmp Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 6.675 13.489 BLBplus -138.6, 170.41 60.57, 44.79 -97.28, 158.99 35.24, 93.11 -75.64, 83.14 out-out out 15.421 Saltbr-out 15.635 HRD-in -61.2, -52.92 69.79, -9.3 out-out-out SNCooo out-out ActLoopNT-out 9.01 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 17.266 APE11-dist-out 22.093 APE10-dist-out 24.077 APE9-dist-out 13.54 S218A,S222A None None EM 2.9 999.0 999.0 B 415 279 40 0 0 0 [[68, 361]] 1.0 9mmq Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 13.545 BLBplus -144.47, 166.22 62.86, 45.64 -102.79, 155.22 38.56, 95.23 -78.03, 72.6 out-out out 15.325 Saltbr-out 15.734 HRD-in -59.38, -50.94 68.52, -2.49 out-out-out SNCooo out-out ActLoopNT-out 8.952 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 17.035 APE11-dist-out 22.006 APE10-dist-out 24.031 APE9-dist-out 13.58 S218A,S222A None None EM 3.9 999.0 999.0 B 415 279 40 0 0 0 [[68, 361]] 1.0 9mmr Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 6.855 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 15.408 Saltbr-out 15.769 HRD-in -66.2, -52.71 70.98, -11.79 out-out-out SNCooo out-out ActLoopNT-out 8.857 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 17.282 APE11-dist-out 22.217 APE10-dist-out 24.353 APE9-dist-out 13.675 S218A,S222A None None EM 3.3 999.0 999.0 B 415 278 40 0 0 0 [[68, 361]] 1.0 9mms Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 15.498 Saltbr-none 999.0 HRD-in -63.91, -56.51 90.24, -35.06 none-out-out SNCnoo out-out ActLoopNT-out 9.29 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 17.155 APE11-dist-out 21.652 APE10-dist-out 23.797 APE9-dist-out 13.499 S218A,S222A None None EM 5.7 999.0 999.0 C 414 306 31 0 0 0 [[68, 361]] 1.0 6q0t Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 15.498 Saltbr-none 999.0 HRD-in -63.96, -56.51 90.23, -35.02 none-out-out SNCnoo out-out ActLoopNT-out 9.29 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 17.156 APE11-dist-out 21.653 APE10-dist-out 23.798 APE9-dist-out 13.498 S218A,S222A None None EM 4.9 999.0 999.0 C 415 306 31 0 0 0 [[68, 361]] 1.0 6q0j Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 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 15.498 Saltbr-none 999.0 HRD-in -63.9, -56.54 90.23, -35.02 none-out-out SNCnoo out-out ActLoopNT-out 9.289 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 17.156 APE11-dist-out 21.654 APE10-dist-out 23.798 APE9-dist-out 13.499 S218A,S222A None None EM 4.9 999.0 999.0 D 415 306 31 0 0 0 [[68, 361]] 1.0 6q0j Homo sapiens STE_MAP2K1_HUMAN STE 1.3e-96 329.0 1 257 257 207 208 209 211 213 97 114 118 187 189 188 190 245 233 228 227 226 225 224 223 222 144 Dual specificity mitogen-activated protein kinase kinase 1

Ligand: LCJ

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

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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