| 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 | MAP4K4 | M4K4_HUMAN | 4U3ZA | O95819 | 17 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGinter | 5.504 | 10.1084 | None | -90.3, 128.59 | 75.45, 163.28 | -151.97, 31.14 | 43.16, 85.73 | 119.13, -6.79 | out-out | out | 13.9945 | Saltbr-out | 13.772 | HRD-in | -72.3, -49.26 | 78.71, -16.24 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.3051 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -98.57, 126.67 | APE9-dihe-na | -83.8, -149.21 | APE8-dihe-in | -69.81, 136.64 | APE8-rot-out | 191.8 | APE67-dihe-in | -65.68, -25.19 | -91.82, -5.09 | APE12-dist-out | 18.0443 | APE11-dist-out | 17.2286 | APE10-dist-out | 18.4608 | APE9-dist-out | 9.95 | T181E | None | None | XRAY | 2.09 | 0.186 | 0.249 | A | 332.0 | 282.0 | 13 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 4u3z | STE_MAP4K4_HUMAN | STE | 2.2e-102 | 347.7 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | Mitogen-activated protein kinase kinase kinase kinase 4 |
| STE | MAP4K4 | M4K4_HUMAN | 4U3ZB | O95819 | 14 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGout | 16.3637 | 5.0186 | None | -61.71, 132.97 | -142.2, 95.96 | -99.94, 27.85 | 284.41, 110.75 | 76.81, -87.36 | out-out | out | 14.2449 | Saltbr-out | 12.9437 | HRD-in | -72.98, -48.48 | 82.25, -12.79 | out-out-out | SNCooo | out-out | ActLoopNT-out | 7.9083 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -74.13, -41.18 | APE9-dihe-na | 98.64, -167.9 | APE8-dihe-in | -91.19, 134.56 | APE8-rot-out | 184.77 | APE67-dihe-in | -58.28, -32.99 | -88.54, -13.57 | APE12-dist-out | 14.9067 | APE11-dist-out | 15.2609 | APE10-dist-out | 17.5937 | APE9-dist-out | 9.505 | T181E | None | None | XRAY | 2.09 | 0.186 | 0.249 | B | 332.0 | 294.0 | 4 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 4u3z | STE_MAP4K4_HUMAN | STE | 2.2e-102 | 347.7 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | Mitogen-activated protein kinase kinase kinase kinase 4 |
| 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 | MAP4K4 | M4K4_HUMAN | 4U3ZA | O95819 | 17 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGinter | 5.504 | 10.1084 | None | -90.3, 128.59 | 75.45, 163.28 | -151.97, 31.14 | 43.16, 85.73 | 119.13, -6.79 | out-out | out | 13.9945 | Saltbr-out | 13.772 | HRD-in | -72.3, -49.26 | 78.71, -16.24 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.3051 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -98.57, 126.67 | APE9-dihe-na | -83.8, -149.21 | APE8-dihe-in | -69.81, 136.64 | APE8-rot-out | 191.8 | APE67-dihe-in | -65.68, -25.19 | -91.82, -5.09 | APE12-dist-out | 18.0443 | APE11-dist-out | 17.2286 | APE10-dist-out | 18.4608 | APE9-dist-out | 9.95 | T181E | None | None | XRAY | 2.09 | 0.186 | 0.249 | A | 332.0 | 282.0 | 13 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 4u3z | Homo sapiens | STE_MAP4K4_HUMAN | STE | 2.2e-102 | 347.7 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | Mitogen-activated protein kinase kinase kinase kinase 4 |
| STE | MAP4K4 | M4K4_HUMAN | 4U3ZB | O95819 | 14 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGout | 16.3637 | 5.0186 | None | -61.71, 132.97 | -142.2, 95.96 | -99.94, 27.85 | 284.41, 110.75 | 76.81, -87.36 | out-out | out | 14.2449 | Saltbr-out | 12.9437 | HRD-in | -72.98, -48.48 | 82.25, -12.79 | out-out-out | SNCooo | out-out | ActLoopNT-out | 7.9083 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -74.13, -41.18 | APE9-dihe-na | 98.64, -167.9 | APE8-dihe-in | -91.19, 134.56 | APE8-rot-out | 184.77 | APE67-dihe-in | -58.28, -32.99 | -88.54, -13.57 | APE12-dist-out | 14.9067 | APE11-dist-out | 15.2609 | APE10-dist-out | 17.5937 | APE9-dist-out | 9.505 | T181E | None | None | XRAY | 2.09 | 0.186 | 0.249 | B | 332.0 | 294.0 | 4 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 4u3z | Homo sapiens | STE_MAP4K4_HUMAN | STE | 2.2e-102 | 347.7 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | Mitogen-activated protein kinase kinase kinase kinase 4 |
| 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 |
|---|