| 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 | 4U3YA | O95819 | 17 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGinter | 5.685 | 10.2954 | None | -88.99, 126.24 | 79.22, 151.13 | -137.58, 35.87 | 48.82, 95.81 | 105.67, -5.01 | out-out | out | 13.9033 | Saltbr-out | 14.4409 | HRD-in | -83.26, -53.16 | 70.55, 5.66 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.7661 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -69.98, -47.61 | APE9-dihe-na | 95.3, -170.42 | APE8-dihe-in | -81.29, 138.53 | APE8-rot-out | 188.11 | APE67-dihe-in | -65.33, -22.86 | -89.45, -12.96 | APE12-dist-out | 15.7712 | APE11-dist-out | 17.3079 | APE10-dist-out | 19.3169 | APE9-dist-out | 9.8362 | None | None | None | XRAY | 1.45 | 0.184 | 0.207 | A | 332.0 | 295.0 | 0 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 4u3y | STE_MAP4K4_HUMAN | STE | 1.7e-102 | 348.1 | 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 | 4U3YB | O95819 | 8 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGout | 15.9836 | 4.7861 | BBAminus | -66.82, 136.69 | -142.99, 93.73 | -97.25, 33.21 | 286.77, 104.13 | 94.14, 55.99 | out-out | out | 14.2412 | Saltbr-out | 11.968 | HRD-in | -69.2, -51.17 | 81.23, -14.38 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.7383 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -101.1, 129.97 | APE9-dihe-na | -81.01, -148.67 | APE8-dihe-in | -77.36, 139.73 | APE8-rot-out | 188.85 | APE67-dihe-in | -65.74, -23.58 | -89.39, -13.52 | APE12-dist-out | 18.5642 | APE11-dist-out | 16.6679 | APE10-dist-out | 17.4754 | APE9-dist-out | 9.2719 | None | None | None | XRAY | 1.45 | 0.184 | 0.207 | B | 332.0 | 300.0 | 4 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 4u3y | STE_MAP4K4_HUMAN | STE | 1.7e-102 | 348.1 | 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 | 4U3YA | O95819 | 17 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGinter | 5.685 | 10.2954 | None | -88.99, 126.24 | 79.22, 151.13 | -137.58, 35.87 | 48.82, 95.81 | 105.67, -5.01 | out-out | out | 13.9033 | Saltbr-out | 14.4409 | HRD-in | -83.26, -53.16 | 70.55, 5.66 | out-out-out | SNCooo | out-out | ActLoopNT-out | 5.7661 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -69.98, -47.61 | APE9-dihe-na | 95.3, -170.42 | APE8-dihe-in | -81.29, 138.53 | APE8-rot-out | 188.11 | APE67-dihe-in | -65.33, -22.86 | -89.45, -12.96 | APE12-dist-out | 15.7712 | APE11-dist-out | 17.3079 | APE10-dist-out | 19.3169 | APE9-dist-out | 9.8362 | None | None | None | XRAY | 1.45 | 0.184 | 0.207 | A | 332.0 | 295.0 | 0 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 4u3y | Homo sapiens | STE_MAP4K4_HUMAN | STE | 1.7e-102 | 348.1 | 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 | 4U3YB | O95819 | 8 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGout | 15.9836 | 4.7861 | BBAminus | -66.82, 136.69 | -142.99, 93.73 | -97.25, 33.21 | 286.77, 104.13 | 94.14, 55.99 | out-out | out | 14.2412 | Saltbr-out | 11.968 | HRD-in | -69.2, -51.17 | 81.23, -14.38 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.7383 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -101.1, 129.97 | APE9-dihe-na | -81.01, -148.67 | APE8-dihe-in | -77.36, 139.73 | APE8-rot-out | 188.85 | APE67-dihe-in | -65.74, -23.58 | -89.39, -13.52 | APE12-dist-out | 18.5642 | APE11-dist-out | 16.6679 | APE10-dist-out | 17.4754 | APE9-dist-out | 9.2719 | None | None | None | XRAY | 1.45 | 0.184 | 0.207 | B | 332.0 | 300.0 | 4 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 4u3y | Homo sapiens | STE_MAP4K4_HUMAN | STE | 1.7e-102 | 348.1 | 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 |
|---|