| 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 | 6NFYA | Q92918 | 10 | 292 | 833.0 | B49:69000 | Type1 | Inactive | DFGin | 5.5935 | 14.9139 | ABAminus | -77.99, -10.08 | -165.37, 178.6 | -100.73, 5.46 | 299.9, 89.52 | 78.01, -158.47 | out-out | out | 11.4151 | Saltbr-out | 8.8062 | HRD-in | -67.76, -54.16 | 80.53, -5.66 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.9718 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -122.43, 132.12 | APE9-dihe-na | -84.67, -151.78 | APE8-dihe-in | -82.18, 120.44 | APE8-rot-in | 317.02 | APE67-dihe-in | -65.57, -25.36 | -45.65, -39.38 | APE12-dist-in | 12.6433 | APE11-dist-in | 8.4543 | APE10-dist-out | 12.9014 | APE9-dist-in | 3.4341 | None | None | None | XRAY | 2.17 | 0.194 | 0.219 | A | 300.0 | 280.0 | 3 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6nfy | STE_MAP4K1_HUMAN | STE | 1.6e-92 | 315.4 | 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 | 6NFYB | Q92918 | 10 | 292 | 833.0 | B49:69000 | Type1 | Inactive | DFGin | 5.4284 | 14.4391 | ABAminus | -77.59, -12.73 | -160.52, 173.22 | -94.5, 5.68 | 304.19, 88.51 | 70.4, -157.51 | out-out | out | 11.1512 | Saltbr-out | 8.0388 | HRD-in | -66.24, -54.13 | 78.28, -9.22 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.0056 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oioi | APE10-dihe-na | -128.67, 114.08 | APE9-dihe-na | -99.5, -109.92 | APE8-dihe-in | -118.15, 107.47 | APE8-rot-in | 308.81 | APE67-dihe-in | -64.32, -24.35 | -45.36, -36.49 | APE12-dist-out | 15.0667 | APE11-dist-in | 10.5996 | APE10-dist-out | 15.1288 | APE9-dist-in | 4.2892 | None | None | None | XRAY | 2.17 | 0.194 | 0.219 | B | 300.0 | 283.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6nfy | STE_MAP4K1_HUMAN | STE | 1.6e-92 | 315.4 | 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 | 6NFYA | Q92918 | 10 | 292 | 833.0 | B49:69000 | Type1 | Inactive | DFGin | 5.5935 | 14.9139 | ABAminus | -77.99, -10.08 | -165.37, 178.6 | -100.73, 5.46 | 299.9, 89.52 | 78.01, -158.47 | out-out | out | 11.4151 | Saltbr-out | 8.8062 | HRD-in | -67.76, -54.16 | 80.53, -5.66 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.9718 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -122.43, 132.12 | APE9-dihe-na | -84.67, -151.78 | APE8-dihe-in | -82.18, 120.44 | APE8-rot-in | 317.02 | APE67-dihe-in | -65.57, -25.36 | -45.65, -39.38 | APE12-dist-in | 12.6433 | APE11-dist-in | 8.4543 | APE10-dist-out | 12.9014 | APE9-dist-in | 3.4341 | None | None | None | XRAY | 2.17 | 0.194 | 0.219 | A | 300.0 | 280.0 | 3 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6nfy | Homo sapiens | STE_MAP4K1_HUMAN | STE | 1.6e-92 | 315.4 | 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 | 6NFYB | Q92918 | 10 | 292 | 833.0 | B49:69000 | Type1 | Inactive | DFGin | 5.4284 | 14.4391 | ABAminus | -77.59, -12.73 | -160.52, 173.22 | -94.5, 5.68 | 304.19, 88.51 | 70.4, -157.51 | out-out | out | 11.1512 | Saltbr-out | 8.0388 | HRD-in | -66.24, -54.13 | 78.28, -9.22 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.0056 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_oioi | APE10-dihe-na | -128.67, 114.08 | APE9-dihe-na | -99.5, -109.92 | APE8-dihe-in | -118.15, 107.47 | APE8-rot-in | 308.81 | APE67-dihe-in | -64.32, -24.35 | -45.36, -36.49 | APE12-dist-out | 15.0667 | APE11-dist-in | 10.5996 | APE10-dist-out | 15.1288 | APE9-dist-in | 4.2892 | None | None | None | XRAY | 2.17 | 0.194 | 0.219 | B | 300.0 | 283.0 | 0 | 28 | 28 | 0 | [[17, 274]] | 1.0 | 6nfy | Homo sapiens | STE_MAP4K1_HUMAN | STE | 1.6e-92 | 315.4 | 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 |
|---|