| 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 | 9BI8A | Q92918 | 6 | 293 | 833.0 | A1APL:60301 | Type1 | Inactive | DFGinter | 10.8795 | 6.3921 | None | -84.61, 129.22 | -97.99, 100.09 | -110.18, 33.34 | 298.01, 131.21 | -69.67, 73.48 | out-out | out | 13.7642 | Saltbr-out | 14.0744 | HRD-in | -72.89, -53.57 | 81.64, -15.14 | out-out-out | SNCooo | out-out | ActLoopNT-out | 12.228 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -88.01, -22.61 | APE9-dihe-na | 97.47, -162.62 | APE8-dihe-in | -70.31, 141.95 | APE8-rot-out | 187.73 | APE67-dihe-in | -58.8, -30.03 | -104.05, -8.58 | APE12-dist-out | 20.5557 | APE11-dist-out | 20.7045 | APE10-dist-out | 21.8391 | APE9-dist-out | 20.9281 | None | None | None | XRAY | 2.25 | 0.203 | 0.271 | A | 311.0 | 288.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9bi8 | STE_MAP4K1_HUMAN | STE | 5e-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 | 9BI8B | Q92918 | 6 | 293 | 833.0 | A1APL:60302 | Type1 | Inactive | DFGinter | 10.7403 | 6.2297 | None | -97.5, 135.14 | -108.73, 95.26 | -106.77, 39.31 | 297.68, 134.76 | -83.18, 62.11 | out-out | out | 13.9969 | Saltbr-out | 14.0393 | HRD-in | -72.45, -53.25 | 76.92, -14.23 | out-out-out | SNCooo | out-out | ActLoopNT-out | 12.839 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -130.02, -27.74 | APE9-dihe-na | 93.81, 172.9 | APE8-dihe-in | -65.36, 145.02 | APE8-rot-out | 198.59 | APE67-dihe-in | -58.71, -28.43 | -102.52, -7.42 | APE12-dist-out | 22.4861 | APE11-dist-out | 22.1016 | APE10-dist-out | 20.5999 | APE9-dist-out | 22.0567 | None | None | None | XRAY | 2.25 | 0.203 | 0.271 | B | 311.0 | 288.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9bi8 | STE_MAP4K1_HUMAN | STE | 5e-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 | 9BI8A | Q92918 | 6 | 293 | 833.0 | A1APL:60301 | Type1 | Inactive | DFGinter | 10.8795 | 6.3921 | None | -84.61, 129.22 | -97.99, 100.09 | -110.18, 33.34 | 298.01, 131.21 | -69.67, 73.48 | out-out | out | 13.7642 | Saltbr-out | 14.0744 | HRD-in | -72.89, -53.57 | 81.64, -15.14 | out-out-out | SNCooo | out-out | ActLoopNT-out | 12.228 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -88.01, -22.61 | APE9-dihe-na | 97.47, -162.62 | APE8-dihe-in | -70.31, 141.95 | APE8-rot-out | 187.73 | APE67-dihe-in | -58.8, -30.03 | -104.05, -8.58 | APE12-dist-out | 20.5557 | APE11-dist-out | 20.7045 | APE10-dist-out | 21.8391 | APE9-dist-out | 20.9281 | None | None | None | XRAY | 2.25 | 0.203 | 0.271 | A | 311.0 | 288.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9bi8 | Homo sapiens | STE_MAP4K1_HUMAN | STE | 5e-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 | 9BI8B | Q92918 | 6 | 293 | 833.0 | A1APL:60302 | Type1 | Inactive | DFGinter | 10.7403 | 6.2297 | None | -97.5, 135.14 | -108.73, 95.26 | -106.77, 39.31 | 297.68, 134.76 | -83.18, 62.11 | out-out | out | 13.9969 | Saltbr-out | 14.0393 | HRD-in | -72.45, -53.25 | 76.92, -14.23 | out-out-out | SNCooo | out-out | ActLoopNT-out | 12.839 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -130.02, -27.74 | APE9-dihe-na | 93.81, 172.9 | APE8-dihe-in | -65.36, 145.02 | APE8-rot-out | 198.59 | APE67-dihe-in | -58.71, -28.43 | -102.52, -7.42 | APE12-dist-out | 22.4861 | APE11-dist-out | 22.1016 | APE10-dist-out | 20.5999 | APE9-dist-out | 22.0567 | None | None | None | XRAY | 2.25 | 0.203 | 0.271 | B | 311.0 | 288.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9bi8 | Homo sapiens | STE_MAP4K1_HUMAN | STE | 5e-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 |
|---|