| 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 | 6NG0A | Q92918 | 6 | 302 | 833.0 | B49:9000 | Type1 | Inactive | DFGin | 5.141 | 15.0649 | None | -69.74, 172.09 | -58.45, 155.47 | -142.74, 154.55 | 54.54, 93.56 | 67.99, -7.56 | out-out | out | 12.8583 | Saltbr-out | 10.8147 | HRD-in | -63.9, -48.24 | 77.74, -8.02 | out-out-out | SNCooo | out-out | ActLoopNT-out | 10.601 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | -51.88, -33.41 | APE9-dihe-na | -72.94, -17.4 | APE8-dihe-in | -134.99, 76.22 | APE8-rot-in | 306.88 | APE67-dihe-in | -54.91, -28.64 | -97.55, -2.9 | APE12-dist-out | 23.0746 | APE11-dist-out | 25.0122 | APE10-dist-out | 24.5939 | APE9-dist-out | 28.7355 | T165E,S171E | None | None | XRAY | 2.05 | 0.202 | 0.229 | A | 309.0 | 289.0 | 8 | 28 | 23 | 5 | [[17, 274]] | 1.0 | 6ng0 | STE_MAP4K1_HUMAN | STE | 4.9e-92 | 313.8 | 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 | 6NG0B | Q92918 | 7 | 293 | 833.0 | B49:9000 | Type1 | Inactive | DFGout | 15.0222 | 9.0265 | BBAminus | -132.93, 173.24 | -130.35, 91.11 | -75.14, -30.73 | 272.68, 88.14 | -91.62, -130.52 | out-out | out | 11.213 | Saltbr-out | 7.483 | HRD-in | -72.09, -46.07 | 68.34, -7.21 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.1101 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -73.37, 118.48 | APE9-dihe-na | -63.42, 177.66 | APE8-dihe-in | -42.4, 131.86 | APE8-rot-out | 56.61 | APE67-dihe-in | -50.2, -28.57 | -93.94, -13.91 | APE12-dist-out | 19.9762 | APE11-dist-out | 20.334 | APE10-dist-out | 21.461 | APE9-dist-out | 26.7294 | T165E,S171E | None | None | XRAY | 2.05 | 0.202 | 0.229 | B | 309.0 | 279.0 | 8 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6ng0 | STE_MAP4K1_HUMAN | STE | 4.9e-92 | 313.8 | 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 | 6NG0A | Q92918 | 6 | 302 | 833.0 | B49:9000 | Type1 | Inactive | DFGin | 5.141 | 15.0649 | None | -69.74, 172.09 | -58.45, 155.47 | -142.74, 154.55 | 54.54, 93.56 | 67.99, -7.56 | out-out | out | 12.8583 | Saltbr-out | 10.8147 | HRD-in | -63.9, -48.24 | 77.74, -8.02 | out-out-out | SNCooo | out-out | ActLoopNT-out | 10.601 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oooo | APE10-dihe-na | -51.88, -33.41 | APE9-dihe-na | -72.94, -17.4 | APE8-dihe-in | -134.99, 76.22 | APE8-rot-in | 306.88 | APE67-dihe-in | -54.91, -28.64 | -97.55, -2.9 | APE12-dist-out | 23.0746 | APE11-dist-out | 25.0122 | APE10-dist-out | 24.5939 | APE9-dist-out | 28.7355 | T165E,S171E | None | None | XRAY | 2.05 | 0.202 | 0.229 | A | 309.0 | 289.0 | 8 | 28 | 23 | 5 | [[17, 274]] | 1.0 | 6ng0 | Homo sapiens | STE_MAP4K1_HUMAN | STE | 4.9e-92 | 313.8 | 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 | 6NG0B | Q92918 | 7 | 293 | 833.0 | B49:9000 | Type1 | Inactive | DFGout | 15.0222 | 9.0265 | BBAminus | -132.93, 173.24 | -130.35, 91.11 | -75.14, -30.73 | 272.68, 88.14 | -91.62, -130.52 | out-out | out | 11.213 | Saltbr-out | 7.483 | HRD-in | -72.09, -46.07 | 68.34, -7.21 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.1101 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -73.37, 118.48 | APE9-dihe-na | -63.42, 177.66 | APE8-dihe-in | -42.4, 131.86 | APE8-rot-out | 56.61 | APE67-dihe-in | -50.2, -28.57 | -93.94, -13.91 | APE12-dist-out | 19.9762 | APE11-dist-out | 20.334 | APE10-dist-out | 21.461 | APE9-dist-out | 26.7294 | T165E,S171E | None | None | XRAY | 2.05 | 0.202 | 0.229 | B | 309.0 | 279.0 | 8 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6ng0 | Homo sapiens | STE_MAP4K1_HUMAN | STE | 4.9e-92 | 313.8 | 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 |
|---|