| 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 | 6CQDA | Q92918 | 2 | 293 | 833.0 | ANP:60301 | ATPlike | Inactive | DFGin | 6.0316 | 13.8855 | BLAminus | -140.97, 178.85 | 65.6, 83.06 | -106.07, 25.72 | 286.0, 93.85 | -58.74, -52.87 | in-in | in | 8.5882 | Saltbr-in | 2.603 | HRD-in | -75.86, -49.25 | 70.86, -6.64 | in-out-out | SNCioo | out-out | ActLoopNT-out | 5.6118 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -107.43, -47.34 | APE9-dihe-na | -128.13, -155.64 | APE8-dihe-in | -106.29, 135.18 | APE8-rot-out | 173.28 | APE67-dihe-in | -57.05, -28.95 | -70.03, -34.9 | APE12-dist-out | 19.7103 | APE11-dist-out | 23.5071 | APE10-dist-out | 22.0831 | APE9-dist-out | 27.3122 | None | None | None | XRAY | 2.12 | 0.206 | 0.25 | A | 297.0 | 288.0 | 4 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6cqd | 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 | 6CQDB | Q92918 | 4 | 293 | 833.0 | ANP:60302 | ATPlike | Inactive | DFGin | 6.1011 | 14.2293 | BLAminus | -144.26, -175.8 | 58.68, 77.54 | -93.97, 33.74 | 292.79, 90.96 | -66.13, -50.88 | in-in | in | 9.463 | Saltbr-in | 3.2089 | HRD-in | -76.3, -46.87 | 66.26, 5.48 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.073 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -81.26, 126.5 | APE9-dihe-na | -81.79, -144.73 | APE8-dihe-in | -66.65, 145.16 | APE8-rot-out | 188.81 | APE67-dihe-in | -66.31, -22.65 | -105.18, -2.62 | APE12-dist-out | 20.7631 | APE11-dist-out | 21.9588 | APE10-dist-out | 21.4095 | APE9-dist-out | 27.357 | None | None | None | XRAY | 2.12 | 0.206 | 0.25 | B | 297.0 | 290.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6cqd | 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 | 6CQDA | Q92918 | 2 | 293 | 833.0 | ANP:60301 | ATPlike | Inactive | DFGin | 6.0316 | 13.8855 | BLAminus | -140.97, 178.85 | 65.6, 83.06 | -106.07, 25.72 | 286.0, 93.85 | -58.74, -52.87 | in-in | in | 8.5882 | Saltbr-in | 2.603 | HRD-in | -75.86, -49.25 | 70.86, -6.64 | in-out-out | SNCioo | out-out | ActLoopNT-out | 5.6118 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -107.43, -47.34 | APE9-dihe-na | -128.13, -155.64 | APE8-dihe-in | -106.29, 135.18 | APE8-rot-out | 173.28 | APE67-dihe-in | -57.05, -28.95 | -70.03, -34.9 | APE12-dist-out | 19.7103 | APE11-dist-out | 23.5071 | APE10-dist-out | 22.0831 | APE9-dist-out | 27.3122 | None | None | None | XRAY | 2.12 | 0.206 | 0.25 | A | 297.0 | 288.0 | 4 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6cqd | 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 | 6CQDB | Q92918 | 4 | 293 | 833.0 | ANP:60302 | ATPlike | Inactive | DFGin | 6.1011 | 14.2293 | BLAminus | -144.26, -175.8 | 58.68, 77.54 | -93.97, 33.74 | 292.79, 90.96 | -66.13, -50.88 | in-in | in | 9.463 | Saltbr-in | 3.2089 | HRD-in | -76.3, -46.87 | 66.26, 5.48 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.073 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -81.26, 126.5 | APE9-dihe-na | -81.79, -144.73 | APE8-dihe-in | -66.65, 145.16 | APE8-rot-out | 188.81 | APE67-dihe-in | -66.31, -22.65 | -105.18, -2.62 | APE12-dist-out | 20.7631 | APE11-dist-out | 21.9588 | APE10-dist-out | 21.4095 | APE9-dist-out | 27.357 | None | None | None | XRAY | 2.12 | 0.206 | 0.25 | B | 297.0 | 290.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6cqd | 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 |
|---|