| 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 | AF-Q92918-K1A | Q92918 | 9 | 282 | 833.0 | No_ligand | No_ligand | Active | DFGin | 6.3851 | 14.3058 | BLAminus | -137.99, 179.33 | 58.7, 63.56 | -81.89, 12.08 | 292.52, 84.97 | -57.46, -34.33 | in-in | in | 8.8339 | Saltbr-in | 2.7358 | HRD-in | -83.11, -47.12 | 66.24, 7.46 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8449 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -145.12, 145.19 | APE9-dihe-na | 133.94, 175.27 | APE8-dihe-in | -87.36, 125.88 | APE8-rot-in | 305.87 | APE67-dihe-in | -73.49, -21.52 | -47.83, -45.86 | APE12-dist-in | 9.0811 | APE11-dist-in | 12.0099 | APE10-dist-in | 6.1943 | APE9-dist-in | 3.4262 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 274.0 | 274.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | AF-Q92918-K1 | STE_MAP4K1_HUMAN | STE | 1.1e-92 | 315.9 | 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 | AF-Q92918-K3A | Q92918 | 9 | 282 | 833.0 | No_ligand | No_ligand | Active | DFGin | 6.2951 | 13.9212 | BLAminus | -134.67, 173.63 | 57.41, 70.5 | -81.88, 9.86 | 290.72, 85.76 | -58.96, -31.66 | in-in | in | 8.8679 | Saltbr-in | 2.7571 | HRD-in | -78.36, -44.81 | 68.44, 4.33 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8114 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.01, 146.33 | APE9-dihe-na | 136.5, 166.99 | APE8-dihe-in | -77.81, 123.18 | APE8-rot-in | 304.84 | APE67-dihe-in | -70.02, -28.12 | -47.87, -44.31 | APE12-dist-in | 8.9733 | APE11-dist-in | 11.841 | APE10-dist-in | 6.1577 | APE9-dist-in | 3.4143 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 274.0 | 274.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | AF-Q92918-K3 | STE_MAP4K1_HUMAN | STE | 1.1e-92 | 315.9 | 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 | AF-Q92918-K1A | Q92918 | 9 | 282 | 833.0 | No_ligand | No_ligand | Active | DFGin | 6.3851 | 14.3058 | BLAminus | -137.99, 179.33 | 58.7, 63.56 | -81.89, 12.08 | 292.52, 84.97 | -57.46, -34.33 | in-in | in | 8.8339 | Saltbr-in | 2.7358 | HRD-in | -83.11, -47.12 | 66.24, 7.46 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8449 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -145.12, 145.19 | APE9-dihe-na | 133.94, 175.27 | APE8-dihe-in | -87.36, 125.88 | APE8-rot-in | 305.87 | APE67-dihe-in | -73.49, -21.52 | -47.83, -45.86 | APE12-dist-in | 9.0811 | APE11-dist-in | 12.0099 | APE10-dist-in | 6.1943 | APE9-dist-in | 3.4262 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 274.0 | 274.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | AF-Q92918-K1 | Homo sapiens | STE_MAP4K1_HUMAN | STE | 1.1e-92 | 315.9 | 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 | AF-Q92918-K3A | Q92918 | 9 | 282 | 833.0 | No_ligand | No_ligand | Active | DFGin | 6.2951 | 13.9212 | BLAminus | -134.67, 173.63 | 57.41, 70.5 | -81.88, 9.86 | 290.72, 85.76 | -58.96, -31.66 | in-in | in | 8.8679 | Saltbr-in | 2.7571 | HRD-in | -78.36, -44.81 | 68.44, 4.33 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8114 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.01, 146.33 | APE9-dihe-na | 136.5, 166.99 | APE8-dihe-in | -77.81, 123.18 | APE8-rot-in | 304.84 | APE67-dihe-in | -70.02, -28.12 | -47.87, -44.31 | APE12-dist-in | 8.9733 | APE11-dist-in | 11.841 | APE10-dist-in | 6.1577 | APE9-dist-in | 3.4143 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 274.0 | 274.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | AF-Q92918-K3 | Homo sapiens | STE_MAP4K1_HUMAN | STE | 1.1e-92 | 315.9 | 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 |
|---|