| 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 | 5LW1B | P45983 | 8 | 362 | 427.0 | ADN:60401 | Type1 | Inactive | DFGin | 4.4197 | 14.4478 | ABAminus | -83.29, -51.84 | -118.5, -177.73 | -115.08, 20.0 | 298.98, 87.21 | 71.2, -159.63 | out-out | out | 10.4298 | Saltbr-out | 3.8124 | HRD-in | -68.61, -60.19 | 64.51, 12.83 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.4773 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oooo | APE10-dihe-na | -136.58, 144.4 | APE9-dihe-na | -122.04, 105.79 | APE8-dihe-out | -71.41, -33.58 | APE8-rot-in | 307.18 | APE67-dihe-in | -61.62, -32.85 | -63.18, -22.53 | APE12-dist-out | 20.0348 | APE11-dist-out | 18.2025 | APE10-dist-out | 13.7638 | APE9-dist-out | 11.7502 | None | None | None | XRAY | 3.2 | 0.177 | 0.212 | B | 373.0 | 355.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 5lw1 | CMGC_MAPK8_HUMAN | CMGC | 4.7e-84 | 288.1 | 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 | 5LW1E | P45983 | 8 | 362 | 427.0 | ADN:60401 | Type1 | Inactive | DFGin | 4.1748 | 14.0755 | ABAminus | -82.51, -53.19 | -119.45, -176.34 | -115.64, 20.66 | 300.14, 87.37 | 72.63, -160.31 | in-out | in | 9.9432 | Saltbr-out | 4.611 | HRD-in | -68.12, -61.52 | 63.83, 14.63 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.8826 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oooo | APE10-dihe-na | -137.31, 145.55 | APE9-dihe-na | -120.94, 104.94 | APE8-dihe-out | -71.75, -32.64 | APE8-rot-in | 307.04 | APE67-dihe-in | -62.19, -31.77 | -62.28, -22.63 | APE12-dist-out | 20.0912 | APE11-dist-out | 18.3879 | APE10-dist-out | 14.0865 | APE9-dist-out | 12.0009 | None | None | None | XRAY | 3.2 | 0.177 | 0.212 | E | 373.0 | 355.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 5lw1 | CMGC_MAPK8_HUMAN | CMGC | 4.7e-84 | 288.1 | 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 | 5LW1H | P45983 | 8 | 362 | 427.0 | ADN:60401 | Type1 | Inactive | DFGin | 4.1303 | 14.3776 | ABAminus | -82.43, -51.23 | -118.2, -176.9 | -114.7, 20.75 | 298.45, 87.29 | 72.11, -159.03 | out-out | out | 10.2847 | Saltbr-out | 3.7377 | HRD-in | -69.31, -61.29 | 63.64, 13.39 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.4743 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oooo | APE10-dihe-na | -136.56, 144.9 | APE9-dihe-na | -119.98, 105.48 | APE8-dihe-out | -71.78, -33.35 | APE8-rot-in | 307.69 | APE67-dihe-in | -61.37, -31.81 | -63.06, -22.73 | APE12-dist-out | 20.0957 | APE11-dist-out | 18.3691 | APE10-dist-out | 13.9653 | APE9-dist-out | 11.9943 | None | None | None | XRAY | 3.2 | 0.177 | 0.212 | H | 373.0 | 355.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 5lw1 | CMGC_MAPK8_HUMAN | CMGC | 4.7e-84 | 288.1 | 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 | 5LW1B | P45983 | 8 | 362 | 427.0 | ADN:60401 | Type1 | Inactive | DFGin | 4.4197 | 14.4478 | ABAminus | -83.29, -51.84 | -118.5, -177.73 | -115.08, 20.0 | 298.98, 87.21 | 71.2, -159.63 | out-out | out | 10.4298 | Saltbr-out | 3.8124 | HRD-in | -68.61, -60.19 | 64.51, 12.83 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.4773 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oooo | APE10-dihe-na | -136.58, 144.4 | APE9-dihe-na | -122.04, 105.79 | APE8-dihe-out | -71.41, -33.58 | APE8-rot-in | 307.18 | APE67-dihe-in | -61.62, -32.85 | -63.18, -22.53 | APE12-dist-out | 20.0348 | APE11-dist-out | 18.2025 | APE10-dist-out | 13.7638 | APE9-dist-out | 11.7502 | None | None | None | XRAY | 3.2 | 0.177 | 0.212 | B | 373.0 | 355.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 5lw1 | Homo sapiens | CMGC_MAPK8_HUMAN | CMGC | 4.7e-84 | 288.1 | 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 | 5LW1E | P45983 | 8 | 362 | 427.0 | ADN:60401 | Type1 | Inactive | DFGin | 4.1748 | 14.0755 | ABAminus | -82.51, -53.19 | -119.45, -176.34 | -115.64, 20.66 | 300.14, 87.37 | 72.63, -160.31 | in-out | in | 9.9432 | Saltbr-out | 4.611 | HRD-in | -68.12, -61.52 | 63.83, 14.63 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.8826 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oooo | APE10-dihe-na | -137.31, 145.55 | APE9-dihe-na | -120.94, 104.94 | APE8-dihe-out | -71.75, -32.64 | APE8-rot-in | 307.04 | APE67-dihe-in | -62.19, -31.77 | -62.28, -22.63 | APE12-dist-out | 20.0912 | APE11-dist-out | 18.3879 | APE10-dist-out | 14.0865 | APE9-dist-out | 12.0009 | None | None | None | XRAY | 3.2 | 0.177 | 0.212 | E | 373.0 | 355.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 5lw1 | Homo sapiens | CMGC_MAPK8_HUMAN | CMGC | 4.7e-84 | 288.1 | 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 | 5LW1H | P45983 | 8 | 362 | 427.0 | ADN:60401 | Type1 | Inactive | DFGin | 4.1303 | 14.3776 | ABAminus | -82.43, -51.23 | -118.2, -176.9 | -114.7, 20.75 | 298.45, 87.29 | 72.11, -159.03 | out-out | out | 10.2847 | Saltbr-out | 3.7377 | HRD-in | -69.31, -61.29 | 63.64, 13.39 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.4743 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_oooo | APE10-dihe-na | -136.56, 144.9 | APE9-dihe-na | -119.98, 105.48 | APE8-dihe-out | -71.78, -33.35 | APE8-rot-in | 307.69 | APE67-dihe-in | -61.37, -31.81 | -63.06, -22.73 | APE12-dist-out | 20.0957 | APE11-dist-out | 18.3691 | APE10-dist-out | 13.9653 | APE9-dist-out | 11.9943 | None | None | None | XRAY | 3.2 | 0.177 | 0.212 | H | 373.0 | 355.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 5lw1 | Homo sapiens | CMGC_MAPK8_HUMAN | CMGC | 4.7e-84 | 288.1 | 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 |
|---|