| 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 | 4QPAA | P28482 | 12 | 357 | 360.0 | 35W:60401 | Type1 | Inactive | DFGin | 6.6307 | 15.6681 | BLAminus | -136.5, -177.35 | 57.93, 81.68 | -102.89, 29.52 | 286.81, 65.92 | -68.51, -24.46 | in-out | in | 9.4927 | Saltbr-out | 3.8625 | HRD-in | -77.16, -44.3 | 70.0, -5.49 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.6862 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -133.82, -177.08 | APE9-dihe-na | -115.74, 137.26 | APE8-dihe-in | -54.82, 121.13 | APE8-rot-in | 306.72 | APE67-dihe-in | -60.3, -21.81 | -45.58, -51.1 | APE12-dist-in | 10.2377 | APE11-dist-in | 9.4922 | APE10-dist-out | 8.8648 | APE9-dist-in | 3.8432 | None | None | NEP125 | XRAY | 2.85 | 0.214 | 0.253 | A | 369.0 | 332.0 | 11 | 31 | 28 | 3 | [[25, 313]] | 1.0 | 4qpa | 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 | 4QPAB | P28482 | 12 | 360 | 360.0 | 35W:60401 | Type1 | Inactive | DFGin | 6.8708 | 16.2178 | BLAminus | -133.06, 176.84 | 64.38, 82.12 | -104.1, 27.34 | 284.96, 71.65 | -64.94, -31.45 | out-in | out | 10.0662 | Saltbr-in | 3.3168 | HRD-in | -76.47, -42.35 | 70.97, -15.95 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.71 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -93.45, -162.2 | APE9-dihe-na | -84.91, -167.23 | APE8-dihe-in | -75.25, 118.31 | APE8-rot-in | 309.12 | APE67-dihe-in | -62.58, -28.37 | -42.27, -50.62 | APE12-dist-in | 11.0287 | APE11-dist-in | 8.7807 | APE10-dist-out | 8.9155 | APE9-dist-in | 4.3175 | None | None | NEP125 | XRAY | 2.85 | 0.214 | 0.253 | B | 369.0 | 346.0 | 2 | 31 | 29 | 2 | [[25, 313]] | 1.0 | 4qpa | 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 | 4QPAA | P28482 | 12 | 357 | 360.0 | 35W:60401 | Type1 | Inactive | DFGin | 6.6307 | 15.6681 | BLAminus | -136.5, -177.35 | 57.93, 81.68 | -102.89, 29.52 | 286.81, 65.92 | -68.51, -24.46 | in-out | in | 9.4927 | Saltbr-out | 3.8625 | HRD-in | -77.16, -44.3 | 70.0, -5.49 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.6862 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -133.82, -177.08 | APE9-dihe-na | -115.74, 137.26 | APE8-dihe-in | -54.82, 121.13 | APE8-rot-in | 306.72 | APE67-dihe-in | -60.3, -21.81 | -45.58, -51.1 | APE12-dist-in | 10.2377 | APE11-dist-in | 9.4922 | APE10-dist-out | 8.8648 | APE9-dist-in | 3.8432 | None | None | NEP125 | XRAY | 2.85 | 0.214 | 0.253 | A | 369.0 | 332.0 | 11 | 31 | 28 | 3 | [[25, 313]] | 1.0 | 4qpa | 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 | 4QPAB | P28482 | 12 | 360 | 360.0 | 35W:60401 | Type1 | Inactive | DFGin | 6.8708 | 16.2178 | BLAminus | -133.06, 176.84 | 64.38, 82.12 | -104.1, 27.34 | 284.96, 71.65 | -64.94, -31.45 | out-in | out | 10.0662 | Saltbr-in | 3.3168 | HRD-in | -76.47, -42.35 | 70.97, -15.95 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.71 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -93.45, -162.2 | APE9-dihe-na | -84.91, -167.23 | APE8-dihe-in | -75.25, 118.31 | APE8-rot-in | 309.12 | APE67-dihe-in | -62.58, -28.37 | -42.27, -50.62 | APE12-dist-in | 11.0287 | APE11-dist-in | 8.7807 | APE10-dist-out | 8.9155 | APE9-dist-in | 4.3175 | None | None | NEP125 | XRAY | 2.85 | 0.214 | 0.253 | B | 369.0 | 346.0 | 2 | 31 | 29 | 2 | [[25, 313]] | 1.0 | 4qpa | 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 |
|---|