| 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 | 9NC2A | Q92918 | 3 | 292 | 833.0 | F97:301 | Type1 | Inactive | DFGin | 6.1691 | 14.5603 | BLAminus | -146.03, -172.66 | 54.61, 75.11 | -87.07, 18.0 | 287.4, 99.86 | -60.8, -42.16 | in-in | in | 9.0771 | Saltbr-in | 3.0839 | HRD-in | -71.62, -49.35 | 69.24, 2.43 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.3647 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -67.88, -25.86 | APE9-dihe-na | 79.92, -176.93 | APE8-dihe-in | -63.28, 137.33 | APE8-rot-out | 195.9 | APE67-dihe-in | -69.31, -23.4 | -99.38, -2.77 | APE12-dist-out | 19.3648 | APE11-dist-out | 20.8695 | APE10-dist-out | 21.6972 | APE9-dist-out | 27.6626 | T165E,S171E | None | None | XRAY | 1.5 | 0.159 | 0.182 | A | 311.0 | 290.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9nc2 | 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 | 9NC2B | Q92918 | 4 | 293 | 833.0 | F97:301 | Type1 | Inactive | DFGin | 6.2192 | 15.3215 | BLAminus | -146.56, -178.89 | 56.97, 76.11 | -90.84, 22.27 | 287.71, 91.06 | -63.05, -41.66 | in-out | in | 9.7402 | Saltbr-out | 4.0801 | HRD-in | -71.95, -49.68 | 67.73, 5.0 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.1071 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -65.85, -26.59 | APE9-dihe-na | 76.68, -178.01 | APE8-dihe-in | -63.02, 140.61 | APE8-rot-out | 197.6 | APE67-dihe-in | -68.97, -20.58 | -101.56, -1.68 | APE12-dist-out | 19.2885 | APE11-dist-out | 20.8191 | APE10-dist-out | 21.7194 | APE9-dist-out | 27.4837 | T165E,S171E | None | None | XRAY | 1.5 | 0.159 | 0.182 | B | 311.0 | 283.0 | 7 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9nc2 | 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 | 9NC2A | Q92918 | 3 | 292 | 833.0 | F97:301 | Type1 | Inactive | DFGin | 6.1691 | 14.5603 | BLAminus | -146.03, -172.66 | 54.61, 75.11 | -87.07, 18.0 | 287.4, 99.86 | -60.8, -42.16 | in-in | in | 9.0771 | Saltbr-in | 3.0839 | HRD-in | -71.62, -49.35 | 69.24, 2.43 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.3647 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -67.88, -25.86 | APE9-dihe-na | 79.92, -176.93 | APE8-dihe-in | -63.28, 137.33 | APE8-rot-out | 195.9 | APE67-dihe-in | -69.31, -23.4 | -99.38, -2.77 | APE12-dist-out | 19.3648 | APE11-dist-out | 20.8695 | APE10-dist-out | 21.6972 | APE9-dist-out | 27.6626 | T165E,S171E | None | None | XRAY | 1.5 | 0.159 | 0.182 | A | 311.0 | 290.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9nc2 | 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 | 9NC2B | Q92918 | 4 | 293 | 833.0 | F97:301 | Type1 | Inactive | DFGin | 6.2192 | 15.3215 | BLAminus | -146.56, -178.89 | 56.97, 76.11 | -90.84, 22.27 | 287.71, 91.06 | -63.05, -41.66 | in-out | in | 9.7402 | Saltbr-out | 4.0801 | HRD-in | -71.95, -49.68 | 67.73, 5.0 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.1071 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -65.85, -26.59 | APE9-dihe-na | 76.68, -178.01 | APE8-dihe-in | -63.02, 140.61 | APE8-rot-out | 197.6 | APE67-dihe-in | -68.97, -20.58 | -101.56, -1.68 | APE12-dist-out | 19.2885 | APE11-dist-out | 20.8191 | APE10-dist-out | 21.7194 | APE9-dist-out | 27.4837 | T165E,S171E | None | None | XRAY | 1.5 | 0.159 | 0.182 | B | 311.0 | 283.0 | 7 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9nc2 | 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 |
|---|