| 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 | 2H96A | P45983 | 7 | 364 | 427.0 | 893:60901 | Type1 | Active | DFGin | 5.7466 | 14.0711 | BLAminus | -142.02, 170.57 | 47.6, 140.71 | -141.49, -1.15 | 291.84, 115.53 | -55.85, -8.38 | in-in | in | 9.1022 | Saltbr-in | 2.8225 | HRD-in | -85.69, -41.32 | 64.83, 4.35 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.806 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -74.81, -40.52 | APE9-dihe-na | -68.31, 154.87 | APE8-dihe-in | -75.38, 102.01 | APE8-rot-in | 313.08 | APE67-dihe-in | -53.52, -10.26 | -11.43, -68.01 | APE12-dist-in | 11.968 | APE11-dist-in | 12.5208 | APE10-dist-in | 7.0412 | APE9-dist-in | 4.4506 | T183E,Y185E | None | None | XRAY | 3.0 | 0.243 | 0.278 | A | 370.0 | 358.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 2h96 | CMGC_MAPK8_HUMAN | CMGC | 2.6e-83 | 285.6 | 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 | 2H96B | P45983 | 7 | 364 | 427.0 | 893:60902 | Type1 | Active | DFGin | 5.8069 | 14.0678 | BLAminus | -144.72, 174.09 | 54.02, 123.29 | -119.24, -14.41 | 278.05, 179.66 | -39.96, -62.74 | in-in | in | 9.0689 | Saltbr-in | 2.9733 | HRD-in | -74.32, -61.93 | 80.7, -10.76 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8668 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -88.3, -36.87 | APE9-dihe-na | -83.37, 136.31 | APE8-dihe-in | -75.86, 124.1 | APE8-rot-in | 311.58 | APE67-dihe-in | -48.77, -30.54 | -42.37, -58.0 | APE12-dist-in | 11.8616 | APE11-dist-in | 12.7575 | APE10-dist-in | 7.2009 | APE9-dist-in | 5.2463 | T183E,Y185E | None | None | XRAY | 3.0 | 0.243 | 0.278 | B | 370.0 | 358.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 2h96 | CMGC_MAPK8_HUMAN | CMGC | 2.6e-83 | 285.6 | 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 | 2H96A | P45983 | 7 | 364 | 427.0 | 893:60901 | Type1 | Active | DFGin | 5.7466 | 14.0711 | BLAminus | -142.02, 170.57 | 47.6, 140.71 | -141.49, -1.15 | 291.84, 115.53 | -55.85, -8.38 | in-in | in | 9.1022 | Saltbr-in | 2.8225 | HRD-in | -85.69, -41.32 | 64.83, 4.35 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.806 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -74.81, -40.52 | APE9-dihe-na | -68.31, 154.87 | APE8-dihe-in | -75.38, 102.01 | APE8-rot-in | 313.08 | APE67-dihe-in | -53.52, -10.26 | -11.43, -68.01 | APE12-dist-in | 11.968 | APE11-dist-in | 12.5208 | APE10-dist-in | 7.0412 | APE9-dist-in | 4.4506 | T183E,Y185E | None | None | XRAY | 3.0 | 0.243 | 0.278 | A | 370.0 | 358.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 2h96 | Homo sapiens | CMGC_MAPK8_HUMAN | CMGC | 2.6e-83 | 285.6 | 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 | 2H96B | P45983 | 7 | 364 | 427.0 | 893:60902 | Type1 | Active | DFGin | 5.8069 | 14.0678 | BLAminus | -144.72, 174.09 | 54.02, 123.29 | -119.24, -14.41 | 278.05, 179.66 | -39.96, -62.74 | in-in | in | 9.0689 | Saltbr-in | 2.9733 | HRD-in | -74.32, -61.93 | 80.7, -10.76 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8668 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -88.3, -36.87 | APE9-dihe-na | -83.37, 136.31 | APE8-dihe-in | -75.86, 124.1 | APE8-rot-in | 311.58 | APE67-dihe-in | -48.77, -30.54 | -42.37, -58.0 | APE12-dist-in | 11.8616 | APE11-dist-in | 12.7575 | APE10-dist-in | 7.2009 | APE9-dist-in | 5.2463 | T183E,Y185E | None | None | XRAY | 3.0 | 0.243 | 0.278 | B | 370.0 | 358.0 | 0 | 27 | 27 | 0 | [[26, 321]] | 1.0 | 2h96 | Homo sapiens | CMGC_MAPK8_HUMAN | CMGC | 2.6e-83 | 285.6 | 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 |
|---|