| 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 | 4QP3A | P28482 | 12 | 360 | 360.0 | 36Q:401 | Type1 | Inactive | DFGin | 6.8589 | 15.8504 | BLAminus | -127.22, -175.68 | 56.17, 83.19 | -104.18, 33.87 | 282.73, 66.64 | -69.96, -32.58 | in-in | in | 9.4451 | Saltbr-in | 3.3006 | HRD-in | -82.76, -44.96 | 76.07, -9.05 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7052 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nioi | APE10-dihe-na | -121.34, 159.1 | APE9-dihe-na | -79.4, 177.88 | APE8-dihe-in | -61.83, 123.04 | APE8-rot-in | 305.81 | APE67-dihe-in | -62.86, -21.0 | -53.45, -47.23 | APE12-dist-none | 999.0 | APE11-dist-in | 8.2622 | APE10-dist-out | 9.9697 | APE9-dist-in | 4.301 | None | None | NEP125 | XRAY | 2.599 | 0.224 | 0.268 | A | 369.0 | 340.0 | 9 | 31 | 25 | 6 | [[25, 313]] | 1.0 | 4qp3 | 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 | 4QP3B | P28482 | 12 | 357 | 360.0 | 36Q:401 | Type1 | Inactive | DFGin | 6.793 | 15.7599 | BLAminus | -126.47, -174.48 | 52.27, 87.61 | -103.66, 26.42 | 284.37, 73.41 | -63.65, -24.28 | in-in | in | 9.6052 | Saltbr-in | 3.1992 | HRD-in | -81.82, -47.44 | 72.19, -4.98 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.6859 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | 63.14, -151.19 | APE9-dihe-na | -73.19, 165.34 | APE8-dihe-in | -60.84, 129.71 | APE8-rot-in | 299.14 | APE67-dihe-in | -62.09, -19.8 | -45.81, -49.44 | APE12-dist-in | 9.7944 | APE11-dist-in | 8.512 | APE10-dist-out | 8.3522 | APE9-dist-in | 3.4733 | None | None | NEP125 | XRAY | 2.599 | 0.224 | 0.268 | B | 369.0 | 332.0 | 11 | 31 | 28 | 3 | [[25, 313]] | 1.0 | 4qp3 | 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 | 4QP3A | P28482 | 12 | 360 | 360.0 | 36Q:401 | Type1 | Inactive | DFGin | 6.8589 | 15.8504 | BLAminus | -127.22, -175.68 | 56.17, 83.19 | -104.18, 33.87 | 282.73, 66.64 | -69.96, -32.58 | in-in | in | 9.4451 | Saltbr-in | 3.3006 | HRD-in | -82.76, -44.96 | 76.07, -9.05 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.7052 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nioi | APE10-dihe-na | -121.34, 159.1 | APE9-dihe-na | -79.4, 177.88 | APE8-dihe-in | -61.83, 123.04 | APE8-rot-in | 305.81 | APE67-dihe-in | -62.86, -21.0 | -53.45, -47.23 | APE12-dist-none | 999.0 | APE11-dist-in | 8.2622 | APE10-dist-out | 9.9697 | APE9-dist-in | 4.301 | None | None | NEP125 | XRAY | 2.599 | 0.224 | 0.268 | A | 369.0 | 340.0 | 9 | 31 | 25 | 6 | [[25, 313]] | 1.0 | 4qp3 | 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 | 4QP3B | P28482 | 12 | 357 | 360.0 | 36Q:401 | Type1 | Inactive | DFGin | 6.793 | 15.7599 | BLAminus | -126.47, -174.48 | 52.27, 87.61 | -103.66, 26.42 | 284.37, 73.41 | -63.65, -24.28 | in-in | in | 9.6052 | Saltbr-in | 3.1992 | HRD-in | -81.82, -47.44 | 72.19, -4.98 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.6859 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | 63.14, -151.19 | APE9-dihe-na | -73.19, 165.34 | APE8-dihe-in | -60.84, 129.71 | APE8-rot-in | 299.14 | APE67-dihe-in | -62.09, -19.8 | -45.81, -49.44 | APE12-dist-in | 9.7944 | APE11-dist-in | 8.512 | APE10-dist-out | 8.3522 | APE9-dist-in | 3.4733 | None | None | NEP125 | XRAY | 2.599 | 0.224 | 0.268 | B | 369.0 | 332.0 | 11 | 31 | 28 | 3 | [[25, 313]] | 1.0 | 4qp3 | 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 |
|---|