| 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 | 8XN7A | Q92918 | 6 | 292 | 833.0 | A1LVT:301 | Type1 | Inactive | DFGout | 14.3454 | 8.5026 | BBAminus | -88.75, 151.47 | -138.7, 126.73 | -107.63, 21.41 | 291.25, 85.46 | -71.58, -35.21 | out-out | out | 12.4522 | Saltbr-out | 9.8213 | HRD-in | -58.31, -58.38 | 91.57, -25.59 | out-out-out | SNCooo | out-out | ActLoopNT-out | 10.8634 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | -64.68, -28.8 | APE9-dihe-na | 70.41, -167.61 | APE8-dihe-in | -58.65, 130.58 | APE8-rot-in | 298.7 | APE67-dihe-in | -73.02, -31.33 | -104.12, 4.31 | APE12-dist-out | 17.7386 | APE11-dist-out | 17.8864 | APE10-dist-out | 17.9808 | APE9-dist-out | 22.5317 | T165E,S171E | None | None | XRAY | 2.65 | 0.216 | 0.23 | A | 296.0 | 287.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 8xn7 | STE_MAP4K1_HUMAN | STE | 4.2e-92 | 314.0 | 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 | 8XN7B | Q92918 | 6 | 293 | 833.0 | A1LVT:301 | Type1 | Inactive | DFGout | 14.3441 | 8.4405 | BBAminus | -88.25, 152.38 | -137.37, 125.89 | -108.54, 21.47 | 292.51, 85.61 | -69.84, -31.75 | out-out | out | 12.6464 | Saltbr-out | 9.7837 | HRD-in | -65.26, -49.86 | 82.38, -14.29 | out-out-out | SNCooo | out-out | ActLoopNT-out | 11.2658 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | -70.2, -26.89 | APE9-dihe-na | 72.95, -172.4 | APE8-dihe-in | -61.15, 131.32 | APE8-rot-in | 303.09 | APE67-dihe-in | -73.29, -31.98 | -103.73, 3.33 | APE12-dist-out | 17.7838 | APE11-dist-out | 16.391 | APE10-dist-out | 16.978 | APE9-dist-out | 21.5148 | T165E,S171E | None | None | XRAY | 2.65 | 0.216 | 0.23 | B | 296.0 | 288.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 8xn7 | STE_MAP4K1_HUMAN | STE | 4.2e-92 | 314.0 | 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 | 8XN7A | Q92918 | 6 | 292 | 833.0 | A1LVT:301 | Type1 | Inactive | DFGout | 14.3454 | 8.5026 | BBAminus | -88.75, 151.47 | -138.7, 126.73 | -107.63, 21.41 | 291.25, 85.46 | -71.58, -35.21 | out-out | out | 12.4522 | Saltbr-out | 9.8213 | HRD-in | -58.31, -58.38 | 91.57, -25.59 | out-out-out | SNCooo | out-out | ActLoopNT-out | 10.8634 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | -64.68, -28.8 | APE9-dihe-na | 70.41, -167.61 | APE8-dihe-in | -58.65, 130.58 | APE8-rot-in | 298.7 | APE67-dihe-in | -73.02, -31.33 | -104.12, 4.31 | APE12-dist-out | 17.7386 | APE11-dist-out | 17.8864 | APE10-dist-out | 17.9808 | APE9-dist-out | 22.5317 | T165E,S171E | None | None | XRAY | 2.65 | 0.216 | 0.23 | A | 296.0 | 287.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 8xn7 | Homo sapiens | STE_MAP4K1_HUMAN | STE | 4.2e-92 | 314.0 | 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 | 8XN7B | Q92918 | 6 | 293 | 833.0 | A1LVT:301 | Type1 | Inactive | DFGout | 14.3441 | 8.4405 | BBAminus | -88.25, 152.38 | -137.37, 125.89 | -108.54, 21.47 | 292.51, 85.61 | -69.84, -31.75 | out-out | out | 12.6464 | Saltbr-out | 9.7837 | HRD-in | -65.26, -49.86 | 82.38, -14.29 | out-out-out | SNCooo | out-out | ActLoopNT-out | 11.2658 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | -70.2, -26.89 | APE9-dihe-na | 72.95, -172.4 | APE8-dihe-in | -61.15, 131.32 | APE8-rot-in | 303.09 | APE67-dihe-in | -73.29, -31.98 | -103.73, 3.33 | APE12-dist-out | 17.7838 | APE11-dist-out | 16.391 | APE10-dist-out | 16.978 | APE9-dist-out | 21.5148 | T165E,S171E | None | None | XRAY | 2.65 | 0.216 | 0.23 | B | 296.0 | 288.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 8xn7 | Homo sapiens | STE_MAP4K1_HUMAN | STE | 4.2e-92 | 314.0 | 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 |
|---|