| 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 | MAPK8 | MK08_HUMAN | 3O17A | P45983 | 7 | 363 | 427.0 | No_ligand | No_ligand | Active | DFGin | 6.1281 | 13.9918 | BLAminus | -143.08, -155.15 | 4.86, 119.05 | -115.61, 15.13 | 291.48, 95.12 | -55.48, -42.85 | in-in | in | 8.9255 | Saltbr-in | 2.9771 | HRD-in | -88.38, -43.35 | 58.03, 10.08 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.3731 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -76.55, -54.88 | APE9-dihe-na | -56.03, 107.98 | APE8-dihe-in | -41.53, 122.11 | APE8-rot-in | 303.39 | APE67-dihe-in | -26.7, -32.66 | -31.75, -85.44 | APE12-dist-in | 10.5963 | APE11-dist-in | 11.6428 | APE10-dist-in | 6.8427 | APE9-dist-in | 4.5653 | T183E,Y185E | None | None | XRAY | 3.0 | 0.263 | 0.308 | A | 370.0 | 357.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 3o17 | CMGC_MAPK8_HUMAN | CMGC | 1.6e-83 | 286.4 | 1.0 | 301.0 | 301.0 | 168 | 169 | 170 | 172 | 174 | 55 | 73 | 77 | 148 | 150 | 149 | 151.0 | 207 | 195 | 190 | 189 | 188 | 187 | 186 | 185 | 184 | 109 | Mitogen-activated protein kinase 8 |
| CMGC | MAPK8 | MK08_HUMAN | 3O17B | P45983 | 7 | 363 | 427.0 | No_ligand | No_ligand | Active | DFGin | 6.3772 | 13.3535 | BLAminus | -141.52, 176.46 | 56.9, 126.68 | -136.61, 6.27 | 299.25, 120.4 | -50.46, -23.38 | in-in | in | 9.2139 | Saltbr-in | 3.0929 | HRD-in | -88.24, -52.87 | 72.9, -9.22 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.4939 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -59.17, -32.26 | APE9-dihe-na | -88.08, 142.34 | APE8-dihe-in | -62.23, 117.26 | APE8-rot-in | 321.66 | APE67-dihe-in | -47.49, -37.82 | -30.24, -67.12 | APE12-dist-in | 11.7384 | APE11-dist-in | 12.4339 | APE10-dist-in | 7.0415 | APE9-dist-in | 4.5416 | T183E,Y185E | None | None | XRAY | 3.0 | 0.263 | 0.308 | B | 370.0 | 357.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 3o17 | CMGC_MAPK8_HUMAN | CMGC | 1.6e-83 | 286.4 | 1.0 | 301.0 | 301.0 | 168 | 169 | 170 | 172 | 174 | 55 | 73 | 77 | 148 | 150 | 149 | 151.0 | 207 | 195 | 190 | 189 | 188 | 187 | 186 | 185 | 184 | 109 | Mitogen-activated protein kinase 8 |
| 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 | MAPK8 | MK08_HUMAN | 3O17A | P45983 | 7 | 363 | 427.0 | No_ligand | No_ligand | Active | DFGin | 6.1281 | 13.9918 | BLAminus | -143.08, -155.15 | 4.86, 119.05 | -115.61, 15.13 | 291.48, 95.12 | -55.48, -42.85 | in-in | in | 8.9255 | Saltbr-in | 2.9771 | HRD-in | -88.38, -43.35 | 58.03, 10.08 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.3731 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -76.55, -54.88 | APE9-dihe-na | -56.03, 107.98 | APE8-dihe-in | -41.53, 122.11 | APE8-rot-in | 303.39 | APE67-dihe-in | -26.7, -32.66 | -31.75, -85.44 | APE12-dist-in | 10.5963 | APE11-dist-in | 11.6428 | APE10-dist-in | 6.8427 | APE9-dist-in | 4.5653 | T183E,Y185E | None | None | XRAY | 3.0 | 0.263 | 0.308 | A | 370.0 | 357.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 3o17 | Homo sapiens | CMGC_MAPK8_HUMAN | CMGC | 1.6e-83 | 286.4 | 1.0 | 301.0 | 301.0 | 168 | 169 | 170 | 172 | 174 | 55 | 73 | 77 | 148 | 150 | 149 | 151.0 | 207 | 195 | 190 | 189 | 188 | 187 | 186 | 185 | 184 | 109 | Mitogen-activated protein kinase 8 |
| CMGC | MAPK8 | MK08_HUMAN | 3O17B | P45983 | 7 | 363 | 427.0 | No_ligand | No_ligand | Active | DFGin | 6.3772 | 13.3535 | BLAminus | -141.52, 176.46 | 56.9, 126.68 | -136.61, 6.27 | 299.25, 120.4 | -50.46, -23.38 | in-in | in | 9.2139 | Saltbr-in | 3.0929 | HRD-in | -88.24, -52.87 | 72.9, -9.22 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.4939 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -59.17, -32.26 | APE9-dihe-na | -88.08, 142.34 | APE8-dihe-in | -62.23, 117.26 | APE8-rot-in | 321.66 | APE67-dihe-in | -47.49, -37.82 | -30.24, -67.12 | APE12-dist-in | 11.7384 | APE11-dist-in | 12.4339 | APE10-dist-in | 7.0415 | APE9-dist-in | 4.5416 | T183E,Y185E | None | None | XRAY | 3.0 | 0.263 | 0.308 | B | 370.0 | 357.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 3o17 | Homo sapiens | CMGC_MAPK8_HUMAN | CMGC | 1.6e-83 | 286.4 | 1.0 | 301.0 | 301.0 | 168 | 169 | 170 | 172 | 174 | 55 | 73 | 77 | 148 | 150 | 149 | 151.0 | 207 | 195 | 190 | 189 | 188 | 187 | 186 | 185 | 184 | 109 | Mitogen-activated protein kinase 8 |
| 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 |
|---|