| 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 | 4QP2B | P28482 | 12 | 357 | 360.0 | No_ligand | No_ligand | Inactive | DFGin | 6.8869 | 16.0169 | BLAminus | -129.43, -178.45 | 61.61, 82.07 | -103.18, 25.26 | 281.28, 72.06 | -66.08, -26.0 | in-in | in | 9.5302 | Saltbr-in | 3.519 | HRD-in | -78.87, -43.35 | 76.42, -19.49 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8623 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -170.24, 153.12 | APE9-dihe-na | -111.49, 162.96 | APE8-dihe-in | -53.17, 118.09 | APE8-rot-in | 309.96 | APE67-dihe-in | -60.93, -24.17 | -46.56, -46.97 | APE12-dist-in | 10.876 | APE11-dist-in | 10.5581 | APE10-dist-out | 9.6191 | APE9-dist-in | 4.625 | None | None | NEP125 | XRAY | 2.23 | 0.186 | 0.234 | B | 369.0 | 330.0 | 13 | 31 | 28 | 3 | [[25, 313]] | 1.0 | 4qp2 | 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 | 4QP2A | P28482 | 12 | 360 | 360.0 | 36R:401 | Type1 | Inactive | DFGin | 7.0169 | 16.3573 | BLAminus | -132.76, -176.99 | 60.37, 76.22 | -97.44, 23.32 | 283.67, 70.96 | -63.1, -20.06 | in-in | in | 9.9583 | Saltbr-in | 3.2131 | HRD-in | -76.56, -48.46 | 78.73, -15.62 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.6898 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nooi | APE10-dihe-na | -88.71, 155.85 | APE9-dihe-na | -97.01, 160.1 | APE8-dihe-in | -54.37, 118.09 | APE8-rot-in | 313.36 | APE67-dihe-in | -58.35, -23.39 | -45.67, -50.34 | APE12-dist-none | 999.0 | APE11-dist-out | 7.8812 | APE10-dist-out | 9.9482 | APE9-dist-in | 4.4264 | None | None | NEP125 | XRAY | 2.23 | 0.186 | 0.234 | A | 369.0 | 337.0 | 9 | 31 | 25 | 6 | [[25, 313]] | 1.0 | 4qp2 | 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 | 4QP2B | P28482 | 12 | 357 | 360.0 | No_ligand | No_ligand | Inactive | DFGin | 6.8869 | 16.0169 | BLAminus | -129.43, -178.45 | 61.61, 82.07 | -103.18, 25.26 | 281.28, 72.06 | -66.08, -26.0 | in-in | in | 9.5302 | Saltbr-in | 3.519 | HRD-in | -78.87, -43.35 | 76.42, -19.49 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8623 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -170.24, 153.12 | APE9-dihe-na | -111.49, 162.96 | APE8-dihe-in | -53.17, 118.09 | APE8-rot-in | 309.96 | APE67-dihe-in | -60.93, -24.17 | -46.56, -46.97 | APE12-dist-in | 10.876 | APE11-dist-in | 10.5581 | APE10-dist-out | 9.6191 | APE9-dist-in | 4.625 | None | None | NEP125 | XRAY | 2.23 | 0.186 | 0.234 | B | 369.0 | 330.0 | 13 | 31 | 28 | 3 | [[25, 313]] | 1.0 | 4qp2 | 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 | 4QP2A | P28482 | 12 | 360 | 360.0 | 36R:401 | Type1 | Inactive | DFGin | 7.0169 | 16.3573 | BLAminus | -132.76, -176.99 | 60.37, 76.22 | -97.44, 23.32 | 283.67, 70.96 | -63.1, -20.06 | in-in | in | 9.9583 | Saltbr-in | 3.2131 | HRD-in | -76.56, -48.46 | 78.73, -15.62 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.6898 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nooi | APE10-dihe-na | -88.71, 155.85 | APE9-dihe-na | -97.01, 160.1 | APE8-dihe-in | -54.37, 118.09 | APE8-rot-in | 313.36 | APE67-dihe-in | -58.35, -23.39 | -45.67, -50.34 | APE12-dist-none | 999.0 | APE11-dist-out | 7.8812 | APE10-dist-out | 9.9482 | APE9-dist-in | 4.4264 | None | None | NEP125 | XRAY | 2.23 | 0.186 | 0.234 | A | 369.0 | 337.0 | 9 | 31 | 25 | 6 | [[25, 313]] | 1.0 | 4qp2 | 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 |
|---|