| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | MAPK1 | MK01_HUMAN | 4IZ5A | P28482 | 11 | 357 | 360.0 | ADP:900 | ATPlike | Inactive | DFGin | 6.5744 | 16.2257 | BLAminus | -133.03, 170.47 | 61.68, 96.87 | -113.24, 29.97 | 280.98, 72.88 | -75.05, -15.97 | in-out | in | 8.9431 | Saltbr-out | 6.3365 | HRD-in | -70.37, -54.19 | 76.22, -6.05 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8045 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooo | APE10-dihe-na | -135.59, 107.64 | APE9-dihe-na | -86.59, -36.52 | APE8-dihe-in | -63.86, 130.93 | APE8-rot-in | 305.07 | APE67-dihe-in | -64.33, -26.99 | -124.19, 30.24 | APE12-dist-in | 10.0117 | APE11-dist-out | 7.082 | APE10-dist-out | 8.2491 | APE9-dist-out | 10.5104 | T185E | None | None | XRAY | 3.19 | 0.245 | 0.292 | A | 356.0 | 347.0 | 0 | 31 | 31 | 0 | [[25, 313]] | 1.0 | 4iz5 | CMGC_MAPK1_HUMAN | CMGC | 2.5e-85 | 292.3 | 1.0 | 301.0 | 301.0 | 166 | 167 | 168 | 170 | 172 | 54 | 71 | 75 | 146 | 148 | 147 | 149.0 | 210 | 197 | 192 | 191 | 190 | 189 | 188 | 187 | 186 | 106 | Mitogen-activated protein kinase 1 |
| CMGC | MAPK1 | MK01_HUMAN | 4IZ5B | P28482 | 11 | 357 | 360.0 | ADP:900 | ATPlike | Inactive | DFGin | 6.6142 | 16.236 | BLAminus | -130.77, 169.05 | 63.18, 96.88 | -112.33, 27.86 | 280.9, 72.0 | -73.48, -17.21 | in-out | in | 8.9516 | Saltbr-out | 6.2842 | HRD-in | -71.55, -52.24 | 74.21, -4.59 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.846 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooo | APE10-dihe-na | -135.05, 108.67 | APE9-dihe-na | -88.18, -35.19 | APE8-dihe-in | -65.83, 129.75 | APE8-rot-in | 303.93 | APE67-dihe-in | -64.9, -24.28 | -122.7, 29.42 | APE12-dist-in | 10.0315 | APE11-dist-out | 7.0852 | APE10-dist-out | 8.2498 | APE9-dist-out | 10.5027 | T185E | None | None | XRAY | 3.19 | 0.245 | 0.292 | B | 356.0 | 347.0 | 0 | 31 | 31 | 0 | [[25, 313]] | 1.0 | 4iz5 | CMGC_MAPK1_HUMAN | CMGC | 2.5e-85 | 292.3 | 1.0 | 301.0 | 301.0 | 166 | 167 | 168 | 170 | 172 | 54 | 71 | 75 | 146 | 148 | 147 | 149.0 | 210 | 197 | 192 | 191 | 190 | 189 | 188 | 187 | 186 | 106 | Mitogen-activated protein kinase 1 |
| CMGC | MAPK1 | MK01_HUMAN | 4IZ5C | P28482 | 11 | 357 | 360.0 | ADP:900 | ATPlike | Inactive | DFGin | 6.6044 | 16.2316 | BLAminus | -131.01, 170.44 | 62.04, 96.83 | -112.78, 28.94 | 280.74, 73.4 | -74.17, -17.63 | in-out | in | 8.9448 | Saltbr-out | 6.3598 | HRD-in | -72.88, -51.67 | 75.48, -6.0 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8678 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooo | APE10-dihe-na | -133.99, 108.02 | APE9-dihe-na | -87.46, -36.5 | APE8-dihe-in | -65.77, 130.32 | APE8-rot-in | 303.26 | APE67-dihe-in | -66.37, -24.82 | -122.99, 29.53 | APE12-dist-in | 10.0145 | APE11-dist-out | 7.0682 | APE10-dist-out | 8.2202 | APE9-dist-out | 10.4967 | T185E | None | None | XRAY | 3.19 | 0.245 | 0.292 | C | 356.0 | 347.0 | 0 | 31 | 31 | 0 | [[25, 313]] | 1.0 | 4iz5 | CMGC_MAPK1_HUMAN | CMGC | 2.5e-85 | 292.3 | 1.0 | 301.0 | 301.0 | 166 | 167 | 168 | 170 | 172 | 54 | 71 | 75 | 146 | 148 | 147 | 149.0 | 210 | 197 | 192 | 191 | 190 | 189 | 188 | 187 | 186 | 106 | Mitogen-activated protein kinase 1 |
| CMGC | MAPK1 | MK01_HUMAN | 4IZ5D | P28482 | 11 | 357 | 360.0 | ADP:900 | ATPlike | Inactive | DFGin | 6.6009 | 16.2317 | BLAminus | -131.94, 170.02 | 62.64, 97.08 | -112.75, 27.73 | 280.79, 72.08 | -72.23, -17.73 | in-out | in | 8.9604 | Saltbr-out | 6.3214 | HRD-in | -71.89, -53.7 | 75.24, -4.58 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8465 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooo | APE10-dihe-na | -135.09, 108.16 | APE9-dihe-na | -88.37, -35.4 | APE8-dihe-in | -66.59, 130.93 | APE8-rot-in | 303.88 | APE67-dihe-in | -65.41, -25.44 | -123.75, 30.53 | APE12-dist-in | 10.0122 | APE11-dist-out | 7.0881 | APE10-dist-out | 8.224 | APE9-dist-out | 10.4605 | T185E | None | None | XRAY | 3.19 | 0.245 | 0.292 | D | 356.0 | 347.0 | 0 | 31 | 31 | 0 | [[25, 313]] | 1.0 | 4iz5 | CMGC_MAPK1_HUMAN | CMGC | 2.5e-85 | 292.3 | 1.0 | 301.0 | 301.0 | 166 | 167 | 168 | 170 | 172 | 54 | 71 | 75 | 146 | 148 | 147 | 149.0 | 210 | 197 | 192 | 191 | 190 | 189 | 188 | 187 | 186 | 106 | Mitogen-activated protein kinase 1 |
| 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 | MAPK1 | MK01_HUMAN | 4IZ5A | P28482 | 11 | 357 | 360.0 | ADP:900 | ATPlike | Inactive | DFGin | 6.5744 | 16.2257 | BLAminus | -133.03, 170.47 | 61.68, 96.87 | -113.24, 29.97 | 280.98, 72.88 | -75.05, -15.97 | in-out | in | 8.9431 | Saltbr-out | 6.3365 | HRD-in | -70.37, -54.19 | 76.22, -6.05 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8045 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooo | APE10-dihe-na | -135.59, 107.64 | APE9-dihe-na | -86.59, -36.52 | APE8-dihe-in | -63.86, 130.93 | APE8-rot-in | 305.07 | APE67-dihe-in | -64.33, -26.99 | -124.19, 30.24 | APE12-dist-in | 10.0117 | APE11-dist-out | 7.082 | APE10-dist-out | 8.2491 | APE9-dist-out | 10.5104 | T185E | None | None | XRAY | 3.19 | 0.245 | 0.292 | A | 356.0 | 347.0 | 0 | 31 | 31 | 0 | [[25, 313]] | 1.0 | 4iz5 | Homo sapiens | CMGC_MAPK1_HUMAN | CMGC | 2.5e-85 | 292.3 | 1.0 | 301.0 | 301.0 | 166 | 167 | 168 | 170 | 172 | 54 | 71 | 75 | 146 | 148 | 147 | 149.0 | 210 | 197 | 192 | 191 | 190 | 189 | 188 | 187 | 186 | 106 | Mitogen-activated protein kinase 1 |
| CMGC | MAPK1 | MK01_HUMAN | 4IZ5B | P28482 | 11 | 357 | 360.0 | ADP:900 | ATPlike | Inactive | DFGin | 6.6142 | 16.236 | BLAminus | -130.77, 169.05 | 63.18, 96.88 | -112.33, 27.86 | 280.9, 72.0 | -73.48, -17.21 | in-out | in | 8.9516 | Saltbr-out | 6.2842 | HRD-in | -71.55, -52.24 | 74.21, -4.59 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.846 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooo | APE10-dihe-na | -135.05, 108.67 | APE9-dihe-na | -88.18, -35.19 | APE8-dihe-in | -65.83, 129.75 | APE8-rot-in | 303.93 | APE67-dihe-in | -64.9, -24.28 | -122.7, 29.42 | APE12-dist-in | 10.0315 | APE11-dist-out | 7.0852 | APE10-dist-out | 8.2498 | APE9-dist-out | 10.5027 | T185E | None | None | XRAY | 3.19 | 0.245 | 0.292 | B | 356.0 | 347.0 | 0 | 31 | 31 | 0 | [[25, 313]] | 1.0 | 4iz5 | Homo sapiens | CMGC_MAPK1_HUMAN | CMGC | 2.5e-85 | 292.3 | 1.0 | 301.0 | 301.0 | 166 | 167 | 168 | 170 | 172 | 54 | 71 | 75 | 146 | 148 | 147 | 149.0 | 210 | 197 | 192 | 191 | 190 | 189 | 188 | 187 | 186 | 106 | Mitogen-activated protein kinase 1 |
| CMGC | MAPK1 | MK01_HUMAN | 4IZ5C | P28482 | 11 | 357 | 360.0 | ADP:900 | ATPlike | Inactive | DFGin | 6.6044 | 16.2316 | BLAminus | -131.01, 170.44 | 62.04, 96.83 | -112.78, 28.94 | 280.74, 73.4 | -74.17, -17.63 | in-out | in | 8.9448 | Saltbr-out | 6.3598 | HRD-in | -72.88, -51.67 | 75.48, -6.0 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8678 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooo | APE10-dihe-na | -133.99, 108.02 | APE9-dihe-na | -87.46, -36.5 | APE8-dihe-in | -65.77, 130.32 | APE8-rot-in | 303.26 | APE67-dihe-in | -66.37, -24.82 | -122.99, 29.53 | APE12-dist-in | 10.0145 | APE11-dist-out | 7.0682 | APE10-dist-out | 8.2202 | APE9-dist-out | 10.4967 | T185E | None | None | XRAY | 3.19 | 0.245 | 0.292 | C | 356.0 | 347.0 | 0 | 31 | 31 | 0 | [[25, 313]] | 1.0 | 4iz5 | Homo sapiens | CMGC_MAPK1_HUMAN | CMGC | 2.5e-85 | 292.3 | 1.0 | 301.0 | 301.0 | 166 | 167 | 168 | 170 | 172 | 54 | 71 | 75 | 146 | 148 | 147 | 149.0 | 210 | 197 | 192 | 191 | 190 | 189 | 188 | 187 | 186 | 106 | Mitogen-activated protein kinase 1 |
| CMGC | MAPK1 | MK01_HUMAN | 4IZ5D | P28482 | 11 | 357 | 360.0 | ADP:900 | ATPlike | Inactive | DFGin | 6.6009 | 16.2317 | BLAminus | -131.94, 170.02 | 62.64, 97.08 | -112.75, 27.73 | 280.79, 72.08 | -72.23, -17.73 | in-out | in | 8.9604 | Saltbr-out | 6.3214 | HRD-in | -71.89, -53.7 | 75.24, -4.58 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8465 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooo | APE10-dihe-na | -135.09, 108.16 | APE9-dihe-na | -88.37, -35.4 | APE8-dihe-in | -66.59, 130.93 | APE8-rot-in | 303.88 | APE67-dihe-in | -65.41, -25.44 | -123.75, 30.53 | APE12-dist-in | 10.0122 | APE11-dist-out | 7.0881 | APE10-dist-out | 8.224 | APE9-dist-out | 10.4605 | T185E | None | None | XRAY | 3.19 | 0.245 | 0.292 | D | 356.0 | 347.0 | 0 | 31 | 31 | 0 | [[25, 313]] | 1.0 | 4iz5 | Homo sapiens | CMGC_MAPK1_HUMAN | CMGC | 2.5e-85 | 292.3 | 1.0 | 301.0 | 301.0 | 166 | 167 | 168 | 170 | 172 | 54 | 71 | 75 | 146 | 148 | 147 | 149.0 | 210 | 197 | 192 | 191 | 190 | 189 | 188 | 187 | 186 | 106 | Mitogen-activated protein kinase 1 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
| 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 |
|---|