| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | MAP3K8 | M3K8_HUMAN | 4Y83A | P41279 | 73 | 389 | 467.0 | 49B:401 | Type1 | Active | DFGin | 6.0993 | 13.8195 | BLAminus | -124.59, 171.95 | 65.19, 92.7 | -106.98, 18.83 | 296.59, 87.7 | -55.3, -38.71 | in-na | in | 7.9632 | Saltbr-na | 3.95 | HRD-in | -58.39, -44.97 | 76.28, -1.41 | na-in-in | SNCaii | in-in | ActLoopNT-in | 2.9848 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -121.5, 134.53 | APE9-dihe-na | 124.17, -161.58 | APE8-dihe-in | -108.22, 120.72 | APE8-rot-in | 305.37 | APE67-dihe-in | -53.37, -39.86 | -40.43, -53.79 | APE12-dist-in | 10.5733 | APE11-dist-in | 11.4347 | APE10-dist-in | 5.6628 | APE9-dist-in | 3.5955 | None | None | None | XRAY | 2.89 | 0.204 | 0.239 | A | 332.0 | 299.0 | 7 | 28 | 28 | 0 | [[136, 388]] | 1.0 | 4y83 | STE_MAP3K8_HUMAN | STE | 9.9e-75 | 257.3 | 7.0 | 256.0 | 250.0 | 269 | 270 | 271 | 273 | 275 | 167 | 178 | 182 | 250 | 252 | 251 | 253.0 | 309 | 297 | 292 | 291 | 290 | 289 | 288 | 287 | 286 | 208 | Mitogen-activated protein kinase kinase kinase 8 |
| STE | MAP3K8 | M3K8_HUMAN | 4Y83B | P41279 | 73 | 390 | 467.0 | 49B:401 | Type1 | Inactive | DFGin | 6.1087 | 13.8331 | BLAminus | -124.82, 178.39 | 58.04, 91.08 | -107.1, 19.86 | 295.8, 87.89 | -54.55, -39.25 | in-na | in | 7.9545 | Saltbr-na | 3.9252 | HRD-out | -89.84, 93.56 | -65.3, 5.72 | na-in-in | SNCaii | in-in | ActLoopNT-in | 2.9028 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -120.81, 133.53 | APE9-dihe-na | 123.34, -162.02 | APE8-dihe-in | -108.51, 121.14 | APE8-rot-in | 304.25 | APE67-dihe-in | -53.46, -41.03 | -40.77, -53.11 | APE12-dist-in | 10.4389 | APE11-dist-in | 11.3734 | APE10-dist-in | 5.6636 | APE9-dist-in | 3.6903 | None | None | None | XRAY | 2.89 | 0.204 | 0.239 | B | 332.0 | 302.0 | 6 | 28 | 28 | 0 | [[136, 388]] | 1.0 | 4y83 | STE_MAP3K8_HUMAN | STE | 9.9e-75 | 257.3 | 7.0 | 256.0 | 250.0 | 269 | 270 | 271 | 273 | 275 | 167 | 178 | 182 | 250 | 252 | 251 | 253.0 | 309 | 297 | 292 | 291 | 290 | 289 | 288 | 287 | 286 | 208 | Mitogen-activated protein kinase kinase kinase 8 |
| STE | MAP3K8 | M3K8_HUMAN | 4Y83C | P41279 | 74 | 389 | 467.0 | 49B:401 | Type1 | Inactive | DFGin | 5.5842 | 13.4418 | BLAminus | -110.1, 168.68 | 58.93, 91.32 | -105.74, 14.12 | 293.23, 84.53 | -55.17, -37.01 | in-na | in | 7.9364 | Saltbr-na | 999.0 | HRD-out | -77.01, 90.27 | -64.95, 5.59 | na-in-in | SNCaii | in-in | ActLoopNT-in | 2.8475 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -119.68, 133.22 | APE9-dihe-na | 121.85, -162.73 | APE8-dihe-in | -109.52, 121.69 | APE8-rot-in | 305.8 | APE67-dihe-in | -52.55, -40.59 | -40.63, -53.14 | APE12-dist-in | 10.4515 | APE11-dist-in | 11.3786 | APE10-dist-in | 5.6396 | APE9-dist-in | 3.6795 | None | None | None | XRAY | 2.89 | 0.204 | 0.239 | C | 332.0 | 293.0 | 11 | 28 | 27 | 1 | [[136, 388]] | 1.0 | 4y83 | STE_MAP3K8_HUMAN | STE | 9.9e-75 | 257.3 | 7.0 | 256.0 | 250.0 | 269 | 270 | 271 | 273 | 275 | 167 | 178 | 182 | 250 | 252 | 251 | 253.0 | 309 | 297 | 292 | 291 | 290 | 289 | 288 | 287 | 286 | 208 | Mitogen-activated protein kinase kinase 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | MAP3K8 | M3K8_HUMAN | 4Y83A | P41279 | 73 | 389 | 467.0 | 49B:401 | Type1 | Active | DFGin | 6.0993 | 13.8195 | BLAminus | -124.59, 171.95 | 65.19, 92.7 | -106.98, 18.83 | 296.59, 87.7 | -55.3, -38.71 | in-na | in | 7.9632 | Saltbr-na | 3.95 | HRD-in | -58.39, -44.97 | 76.28, -1.41 | na-in-in | SNCaii | in-in | ActLoopNT-in | 2.9848 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -121.5, 134.53 | APE9-dihe-na | 124.17, -161.58 | APE8-dihe-in | -108.22, 120.72 | APE8-rot-in | 305.37 | APE67-dihe-in | -53.37, -39.86 | -40.43, -53.79 | APE12-dist-in | 10.5733 | APE11-dist-in | 11.4347 | APE10-dist-in | 5.6628 | APE9-dist-in | 3.5955 | None | None | None | XRAY | 2.89 | 0.204 | 0.239 | A | 332.0 | 299.0 | 7 | 28 | 28 | 0 | [[136, 388]] | 1.0 | 4y83 | Homo sapiens | STE_MAP3K8_HUMAN | STE | 9.9e-75 | 257.3 | 7.0 | 256.0 | 250.0 | 269 | 270 | 271 | 273 | 275 | 167 | 178 | 182 | 250 | 252 | 251 | 253.0 | 309 | 297 | 292 | 291 | 290 | 289 | 288 | 287 | 286 | 208 | Mitogen-activated protein kinase kinase kinase 8 |
| STE | MAP3K8 | M3K8_HUMAN | 4Y83B | P41279 | 73 | 390 | 467.0 | 49B:401 | Type1 | Inactive | DFGin | 6.1087 | 13.8331 | BLAminus | -124.82, 178.39 | 58.04, 91.08 | -107.1, 19.86 | 295.8, 87.89 | -54.55, -39.25 | in-na | in | 7.9545 | Saltbr-na | 3.9252 | HRD-out | -89.84, 93.56 | -65.3, 5.72 | na-in-in | SNCaii | in-in | ActLoopNT-in | 2.9028 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -120.81, 133.53 | APE9-dihe-na | 123.34, -162.02 | APE8-dihe-in | -108.51, 121.14 | APE8-rot-in | 304.25 | APE67-dihe-in | -53.46, -41.03 | -40.77, -53.11 | APE12-dist-in | 10.4389 | APE11-dist-in | 11.3734 | APE10-dist-in | 5.6636 | APE9-dist-in | 3.6903 | None | None | None | XRAY | 2.89 | 0.204 | 0.239 | B | 332.0 | 302.0 | 6 | 28 | 28 | 0 | [[136, 388]] | 1.0 | 4y83 | Homo sapiens | STE_MAP3K8_HUMAN | STE | 9.9e-75 | 257.3 | 7.0 | 256.0 | 250.0 | 269 | 270 | 271 | 273 | 275 | 167 | 178 | 182 | 250 | 252 | 251 | 253.0 | 309 | 297 | 292 | 291 | 290 | 289 | 288 | 287 | 286 | 208 | Mitogen-activated protein kinase kinase kinase 8 |
| STE | MAP3K8 | M3K8_HUMAN | 4Y83C | P41279 | 74 | 389 | 467.0 | 49B:401 | Type1 | Inactive | DFGin | 5.5842 | 13.4418 | BLAminus | -110.1, 168.68 | 58.93, 91.32 | -105.74, 14.12 | 293.23, 84.53 | -55.17, -37.01 | in-na | in | 7.9364 | Saltbr-na | 999.0 | HRD-out | -77.01, 90.27 | -64.95, 5.59 | na-in-in | SNCaii | in-in | ActLoopNT-in | 2.8475 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -119.68, 133.22 | APE9-dihe-na | 121.85, -162.73 | APE8-dihe-in | -109.52, 121.69 | APE8-rot-in | 305.8 | APE67-dihe-in | -52.55, -40.59 | -40.63, -53.14 | APE12-dist-in | 10.4515 | APE11-dist-in | 11.3786 | APE10-dist-in | 5.6396 | APE9-dist-in | 3.6795 | None | None | None | XRAY | 2.89 | 0.204 | 0.239 | C | 332.0 | 293.0 | 11 | 28 | 27 | 1 | [[136, 388]] | 1.0 | 4y83 | Homo sapiens | STE_MAP3K8_HUMAN | STE | 9.9e-75 | 257.3 | 7.0 | 256.0 | 250.0 | 269 | 270 | 271 | 273 | 275 | 167 | 178 | 182 | 250 | 252 | 251 | 253.0 | 309 | 297 | 292 | 291 | 290 | 289 | 288 | 287 | 286 | 208 | Mitogen-activated protein kinase kinase 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 |
|---|