| 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 | MAP4K1 | M4K1_HUMAN | 6NFZA | Q92918 | 7 | 292 | 833.0 | B49:401 | Type1 | None | DFGin | 6.2841 | 14.0199 | BLAminus | -132.74, -179.97 | 58.53, 80.12 | -96.32, 31.7 | 293.92, 71.67 | -62.29, -28.15 | in-none | in | 8.6336 | Saltbr-none | 999.0 | HRD-in | -77.39, -48.16 | 72.34, -9.45 | none-in-in | SNCnii | in-in | ActLoopNT-in | 2.8383 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -156.28, 161.74 | APE9-dihe-na | 145.04, -157.57 | APE8-dihe-in | -127.09, 102.67 | APE8-rot-in | 298.6 | APE67-dihe-in | -54.23, -29.76 | -34.34, -51.63 | APE12-dist-in | 8.2408 | APE11-dist-in | 11.6256 | APE10-dist-in | 6.1775 | APE9-dist-in | 3.9164 | None | TPO165,SEP171 | TPO165,SEP171 | XRAY | 2.966 | 0.209 | 0.251 | A | 309.0 | 270.0 | 16 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6nfz | STE_MAP4K1_HUMAN | STE | 1.7e-92 | 315.3 | 1.0 | 256.0 | 256.0 | 154 | 155 | 156 | 158 | 160 | 46 | 62 | 66 | 134 | 136 | 135 | 137.0 | 197 | 182 | 177 | 176 | 175 | 174 | 173 | 172 | 171 | 92 | Mitogen-activated protein kinase kinase kinase kinase 1 |
| STE | MAP4K1 | M4K1_HUMAN | 6NFZB | Q92918 | 5 | 292 | 833.0 | B49:9001 | Type1 | Active | DFGin | 6.5693 | 14.1248 | BLAminus | -143.42, 177.82 | 59.84, 65.59 | -92.66, 20.58 | 294.3, 90.38 | -59.43, -39.56 | in-in | in | 8.6509 | Saltbr-in | 3.5599 | HRD-in | -78.49, -47.72 | 65.71, 8.89 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8584 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -156.78, 156.37 | APE9-dihe-na | 142.37, -174.26 | APE8-dihe-in | -102.95, 108.5 | APE8-rot-in | 309.31 | APE67-dihe-in | -65.17, -28.5 | -37.53, -43.95 | APE12-dist-in | 8.1845 | APE11-dist-in | 11.4365 | APE10-dist-in | 5.9754 | APE9-dist-in | 3.8536 | None | TPO165,SEP171 | TPO165,SEP171 | XRAY | 2.966 | 0.209 | 0.251 | B | 309.0 | 277.0 | 11 | 28 | 25 | 3 | [[17, 274]] | 1.0 | 6nfz | STE_MAP4K1_HUMAN | STE | 1.7e-92 | 315.3 | 1.0 | 256.0 | 256.0 | 154 | 155 | 156 | 158 | 160 | 46 | 62 | 66 | 134 | 136 | 135 | 137.0 | 197 | 182 | 177 | 176 | 175 | 174 | 173 | 172 | 171 | 92 | Mitogen-activated protein kinase kinase kinase 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | MAP4K1 | M4K1_HUMAN | 6NFZA | Q92918 | 7 | 292 | 833.0 | B49:401 | Type1 | None | DFGin | 6.2841 | 14.0199 | BLAminus | -132.74, -179.97 | 58.53, 80.12 | -96.32, 31.7 | 293.92, 71.67 | -62.29, -28.15 | in-none | in | 8.6336 | Saltbr-none | 999.0 | HRD-in | -77.39, -48.16 | 72.34, -9.45 | none-in-in | SNCnii | in-in | ActLoopNT-in | 2.8383 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -156.28, 161.74 | APE9-dihe-na | 145.04, -157.57 | APE8-dihe-in | -127.09, 102.67 | APE8-rot-in | 298.6 | APE67-dihe-in | -54.23, -29.76 | -34.34, -51.63 | APE12-dist-in | 8.2408 | APE11-dist-in | 11.6256 | APE10-dist-in | 6.1775 | APE9-dist-in | 3.9164 | None | TPO165,SEP171 | TPO165,SEP171 | XRAY | 2.966 | 0.209 | 0.251 | A | 309.0 | 270.0 | 16 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6nfz | Homo sapiens | STE_MAP4K1_HUMAN | STE | 1.7e-92 | 315.3 | 1.0 | 256.0 | 256.0 | 154 | 155 | 156 | 158 | 160 | 46 | 62 | 66 | 134 | 136 | 135 | 137.0 | 197 | 182 | 177 | 176 | 175 | 174 | 173 | 172 | 171 | 92 | Mitogen-activated protein kinase kinase kinase kinase 1 |
| STE | MAP4K1 | M4K1_HUMAN | 6NFZB | Q92918 | 5 | 292 | 833.0 | B49:9001 | Type1 | Active | DFGin | 6.5693 | 14.1248 | BLAminus | -143.42, 177.82 | 59.84, 65.59 | -92.66, 20.58 | 294.3, 90.38 | -59.43, -39.56 | in-in | in | 8.6509 | Saltbr-in | 3.5599 | HRD-in | -78.49, -47.72 | 65.71, 8.89 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8584 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -156.78, 156.37 | APE9-dihe-na | 142.37, -174.26 | APE8-dihe-in | -102.95, 108.5 | APE8-rot-in | 309.31 | APE67-dihe-in | -65.17, -28.5 | -37.53, -43.95 | APE12-dist-in | 8.1845 | APE11-dist-in | 11.4365 | APE10-dist-in | 5.9754 | APE9-dist-in | 3.8536 | None | TPO165,SEP171 | TPO165,SEP171 | XRAY | 2.966 | 0.209 | 0.251 | B | 309.0 | 277.0 | 11 | 28 | 25 | 3 | [[17, 274]] | 1.0 | 6nfz | Homo sapiens | STE_MAP4K1_HUMAN | STE | 1.7e-92 | 315.3 | 1.0 | 256.0 | 256.0 | 154 | 155 | 156 | 158 | 160 | 46 | 62 | 66 | 134 | 136 | 135 | 137.0 | 197 | 182 | 177 | 176 | 175 | 174 | 173 | 172 | 171 | 92 | Mitogen-activated protein kinase kinase kinase 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 |
|---|