| 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 | 9D00A | Q92918 | 6 | 293 | 833.0 | A1A1A:901 | Type1 | Inactive | DFGin | 6.3356 | 14.4475 | BLAminus | -140.17, 169.69 | 66.05, 82.16 | -90.41, 19.67 | 289.69, 94.63 | -57.9, -45.24 | in-in | in | 9.1471 | Saltbr-in | 2.5436 | HRD-in | -69.4, -52.71 | 68.37, -0.38 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.2391 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -115.73, -16.53 | APE9-dihe-na | 70.33, -148.11 | APE8-dihe-in | -67.12, 125.31 | APE8-rot-out | 58.95 | APE67-dihe-in | -62.24, -23.42 | -101.84, 10.31 | APE12-dist-out | 19.3992 | APE11-dist-out | 20.6356 | APE10-dist-out | 21.3987 | APE9-dist-out | 28.1938 | None | None | None | XRAY | 1.951 | 0.247 | 0.279 | A | 309.0 | 284.0 | 4 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9d00 | 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 | 9D00B | Q92918 | 4 | 292 | 833.0 | A1A1A:401 | Type1 | Inactive | DFGin | 6.3364 | 14.317 | BLAminus | -139.86, 169.35 | 66.73, 83.9 | -91.21, 18.67 | 290.65, 95.0 | -58.22, -46.78 | in-in | in | 9.1799 | Saltbr-in | 2.5442 | HRD-in | -69.48, -53.11 | 69.59, -1.41 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.1897 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -71.7, -18.52 | APE9-dihe-na | 69.55, -149.8 | APE8-dihe-in | -76.21, 127.76 | APE8-rot-out | 54.96 | APE67-dihe-in | -61.76, -27.13 | -102.55, 9.59 | APE12-dist-out | 19.3082 | APE11-dist-out | 20.5052 | APE10-dist-out | 21.5126 | APE9-dist-out | 28.1743 | None | None | None | XRAY | 1.951 | 0.247 | 0.279 | B | 309.0 | 284.0 | 5 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9d00 | 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 | 9D00C | Q92918 | 4 | 293 | 833.0 | A1A1A:401 | Type1 | Inactive | DFGin | 6.2419 | 14.4473 | BLAminus | -140.24, 170.38 | 65.3, 82.76 | -91.49, 20.02 | 291.46, 93.21 | -59.78, -44.19 | in-in | in | 9.119 | Saltbr-in | 2.57 | HRD-in | -70.48, -52.81 | 68.16, -0.69 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.1986 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -95.51, -17.94 | APE9-dihe-na | 66.33, -149.39 | APE8-dihe-in | -68.18, 126.44 | APE8-rot-out | 60.28 | APE67-dihe-in | -61.75, -26.6 | -102.65, 9.42 | APE12-dist-out | 19.7112 | APE11-dist-out | 20.0976 | APE10-dist-out | 21.2741 | APE9-dist-out | 28.0237 | None | None | None | XRAY | 1.951 | 0.247 | 0.279 | C | 309.0 | 284.0 | 6 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9d00 | 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 | 9D00D | Q92918 | 4 | 292 | 833.0 | A1A1A:401 | Type1 | Inactive | DFGin | 6.342 | 14.3714 | BLAminus | -139.3, 170.77 | 65.41, 83.56 | -92.51, 20.91 | 290.0, 94.21 | -58.73, -44.95 | in-in | in | 9.1504 | Saltbr-in | 2.6817 | HRD-in | -70.53, -51.9 | 66.76, -0.27 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.1685 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -82.51, -20.77 | APE9-dihe-na | 70.59, -152.77 | APE8-dihe-in | -74.62, 128.96 | APE8-rot-out | 53.71 | APE67-dihe-in | -61.19, -25.01 | -101.63, 7.98 | APE12-dist-out | 19.4164 | APE11-dist-out | 20.7458 | APE10-dist-out | 21.537 | APE9-dist-out | 28.3143 | None | None | None | XRAY | 1.951 | 0.247 | 0.279 | D | 309.0 | 285.0 | 4 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9d00 | 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 | 9D00A | Q92918 | 6 | 293 | 833.0 | A1A1A:901 | Type1 | Inactive | DFGin | 6.3356 | 14.4475 | BLAminus | -140.17, 169.69 | 66.05, 82.16 | -90.41, 19.67 | 289.69, 94.63 | -57.9, -45.24 | in-in | in | 9.1471 | Saltbr-in | 2.5436 | HRD-in | -69.4, -52.71 | 68.37, -0.38 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.2391 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -115.73, -16.53 | APE9-dihe-na | 70.33, -148.11 | APE8-dihe-in | -67.12, 125.31 | APE8-rot-out | 58.95 | APE67-dihe-in | -62.24, -23.42 | -101.84, 10.31 | APE12-dist-out | 19.3992 | APE11-dist-out | 20.6356 | APE10-dist-out | 21.3987 | APE9-dist-out | 28.1938 | None | None | None | XRAY | 1.951 | 0.247 | 0.279 | A | 309.0 | 284.0 | 4 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9d00 | 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 | 9D00B | Q92918 | 4 | 292 | 833.0 | A1A1A:401 | Type1 | Inactive | DFGin | 6.3364 | 14.317 | BLAminus | -139.86, 169.35 | 66.73, 83.9 | -91.21, 18.67 | 290.65, 95.0 | -58.22, -46.78 | in-in | in | 9.1799 | Saltbr-in | 2.5442 | HRD-in | -69.48, -53.11 | 69.59, -1.41 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.1897 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -71.7, -18.52 | APE9-dihe-na | 69.55, -149.8 | APE8-dihe-in | -76.21, 127.76 | APE8-rot-out | 54.96 | APE67-dihe-in | -61.76, -27.13 | -102.55, 9.59 | APE12-dist-out | 19.3082 | APE11-dist-out | 20.5052 | APE10-dist-out | 21.5126 | APE9-dist-out | 28.1743 | None | None | None | XRAY | 1.951 | 0.247 | 0.279 | B | 309.0 | 284.0 | 5 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9d00 | 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 | 9D00C | Q92918 | 4 | 293 | 833.0 | A1A1A:401 | Type1 | Inactive | DFGin | 6.2419 | 14.4473 | BLAminus | -140.24, 170.38 | 65.3, 82.76 | -91.49, 20.02 | 291.46, 93.21 | -59.78, -44.19 | in-in | in | 9.119 | Saltbr-in | 2.57 | HRD-in | -70.48, -52.81 | 68.16, -0.69 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.1986 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -95.51, -17.94 | APE9-dihe-na | 66.33, -149.39 | APE8-dihe-in | -68.18, 126.44 | APE8-rot-out | 60.28 | APE67-dihe-in | -61.75, -26.6 | -102.65, 9.42 | APE12-dist-out | 19.7112 | APE11-dist-out | 20.0976 | APE10-dist-out | 21.2741 | APE9-dist-out | 28.0237 | None | None | None | XRAY | 1.951 | 0.247 | 0.279 | C | 309.0 | 284.0 | 6 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9d00 | 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 | 9D00D | Q92918 | 4 | 292 | 833.0 | A1A1A:401 | Type1 | Inactive | DFGin | 6.342 | 14.3714 | BLAminus | -139.3, 170.77 | 65.41, 83.56 | -92.51, 20.91 | 290.0, 94.21 | -58.73, -44.95 | in-in | in | 9.1504 | Saltbr-in | 2.6817 | HRD-in | -70.53, -51.9 | 66.76, -0.27 | in-out-out | SNCioo | out-out | ActLoopNT-out | 6.1685 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -82.51, -20.77 | APE9-dihe-na | 70.59, -152.77 | APE8-dihe-in | -74.62, 128.96 | APE8-rot-out | 53.71 | APE67-dihe-in | -61.19, -25.01 | -101.63, 7.98 | APE12-dist-out | 19.4164 | APE11-dist-out | 20.7458 | APE10-dist-out | 21.537 | APE9-dist-out | 28.3143 | None | None | None | XRAY | 1.951 | 0.247 | 0.279 | D | 309.0 | 285.0 | 4 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 9d00 | 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 |
|---|