| 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 | 4QP4A | P28482 | 13 | 357 | 360.0 | 36O:401 | Type1 | Inactive | DFGin | 6.8241 | 15.938 | BLAminus | -125.3, 167.13 | 64.24, 90.48 | -108.14, 22.59 | 286.42, 75.22 | -64.25, -26.15 | in-out | in | 8.9178 | Saltbr-out | 6.0785 | HRD-in | -71.48, -47.45 | 75.24, -9.93 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9796 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioo | APE10-dihe-na | -129.97, 154.52 | APE9-dihe-na | -62.24, -33.02 | APE8-dihe-in | -154.8, 145.42 | APE8-rot-out | 182.51 | APE67-dihe-in | -65.24, -7.26 | -115.09, 10.29 | APE12-dist-in | 9.2228 | APE11-dist-in | 12.394 | APE10-dist-out | 9.1008 | APE9-dist-out | 11.038 | None | None | None | XRAY | 2.2 | 0.189 | 0.235 | A | 369.0 | 337.0 | 8 | 31 | 23 | 8 | [[25, 313]] | 1.0 | 4qp4 | CMGC_MAPK1_HUMAN | CMGC | 1e-85 | 293.6 | 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 | 4QP4B | P28482 | 12 | 357 | 360.0 | 36O:401 | Type1 | Inactive | DFGin | 6.9518 | 16.3408 | BLAminus | -131.86, 174.32 | 59.22, 89.07 | -106.19, 23.73 | 288.41, 79.68 | -67.52, -18.25 | in-out | in | 9.2153 | Saltbr-out | 4.4894 | HRD-in | -76.21, -48.26 | 75.02, -6.33 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8132 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioo | APE10-dihe-na | -122.9, 128.44 | APE9-dihe-na | -79.48, -89.06 | APE8-dihe-in | -75.04, 141.7 | APE8-rot-in | 317.37 | APE67-dihe-in | -69.0, -20.44 | -124.09, -5.27 | APE12-dist-in | 9.1797 | APE11-dist-in | 12.4613 | APE10-dist-out | 11.2141 | APE9-dist-out | 10.244 | None | None | None | XRAY | 2.2 | 0.189 | 0.235 | B | 369.0 | 335.0 | 11 | 31 | 20 | 11 | [[25, 313]] | 1.0 | 4qp4 | CMGC_MAPK1_HUMAN | CMGC | 1e-85 | 293.6 | 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 | 4QP4A | P28482 | 13 | 357 | 360.0 | 36O:401 | Type1 | Inactive | DFGin | 6.8241 | 15.938 | BLAminus | -125.3, 167.13 | 64.24, 90.48 | -108.14, 22.59 | 286.42, 75.22 | -64.25, -26.15 | in-out | in | 8.9178 | Saltbr-out | 6.0785 | HRD-in | -71.48, -47.45 | 75.24, -9.93 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9796 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioo | APE10-dihe-na | -129.97, 154.52 | APE9-dihe-na | -62.24, -33.02 | APE8-dihe-in | -154.8, 145.42 | APE8-rot-out | 182.51 | APE67-dihe-in | -65.24, -7.26 | -115.09, 10.29 | APE12-dist-in | 9.2228 | APE11-dist-in | 12.394 | APE10-dist-out | 9.1008 | APE9-dist-out | 11.038 | None | None | None | XRAY | 2.2 | 0.189 | 0.235 | A | 369.0 | 337.0 | 8 | 31 | 23 | 8 | [[25, 313]] | 1.0 | 4qp4 | Homo sapiens | CMGC_MAPK1_HUMAN | CMGC | 1e-85 | 293.6 | 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 | 4QP4B | P28482 | 12 | 357 | 360.0 | 36O:401 | Type1 | Inactive | DFGin | 6.9518 | 16.3408 | BLAminus | -131.86, 174.32 | 59.22, 89.07 | -106.19, 23.73 | 288.41, 79.68 | -67.52, -18.25 | in-out | in | 9.2153 | Saltbr-out | 4.4894 | HRD-in | -76.21, -48.26 | 75.02, -6.33 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8132 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioo | APE10-dihe-na | -122.9, 128.44 | APE9-dihe-na | -79.48, -89.06 | APE8-dihe-in | -75.04, 141.7 | APE8-rot-in | 317.37 | APE67-dihe-in | -69.0, -20.44 | -124.09, -5.27 | APE12-dist-in | 9.1797 | APE11-dist-in | 12.4613 | APE10-dist-out | 11.2141 | APE9-dist-out | 10.244 | None | None | None | XRAY | 2.2 | 0.189 | 0.235 | B | 369.0 | 335.0 | 11 | 31 | 20 | 11 | [[25, 313]] | 1.0 | 4qp4 | Homo sapiens | CMGC_MAPK1_HUMAN | CMGC | 1e-85 | 293.6 | 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 |
|---|