| 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 | MAP4K3 | M4K3_HUMAN | AF-Q8IVH8-K1A | Q8IVH8 | 8 | 281 | 894.0 | No_ligand | No_ligand | Active | DFGin | 6.0587 | 13.8866 | BLAminus | -135.09, 176.01 | 60.66, 69.27 | -88.36, 10.08 | 297.84, 97.93 | -55.05, -43.84 | in-in | in | 8.0711 | Saltbr-in | 2.7199 | HRD-in | -86.04, -45.82 | 66.69, 5.33 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8691 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -149.39, 153.76 | APE9-dihe-na | 120.56, 171.92 | APE8-dihe-in | -77.71, 132.65 | APE8-rot-in | 305.52 | APE67-dihe-inflip | 73.55, -40.51 | -49.39, 160.24 | APE12-dist-in | 8.6508 | APE11-dist-in | 11.6998 | APE10-dist-in | 5.9401 | APE9-dist-in | 3.4578 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 274.0 | 274.0 | 0 | 28 | 28 | 0 | [[16, 273]] | 1.0 | AF-Q8IVH8-K1 | STE_MAP4K3_HUMAN | STE | 4.8e-100 | 340.1 | 1.0 | 257.0 | 257.0 | 153 | 154 | 155 | 157 | 159 | 45 | 61 | 65 | 133 | 135 | 134 | 136.0 | 196 | 181 | 176 | 175 | 174 | 173 | 172 | 171 | 170 | 91 | Mitogen-activated protein kinase kinase kinase kinase 3 |
| STE | MAP4K3 | M4K3_HUMAN | AF-Q8IVH8-K3A | Q8IVH8 | 8 | 281 | 894.0 | No_ligand | No_ligand | Active | DFGin | 5.9406 | 14.1137 | BLAminus | -134.97, 173.95 | 56.18, 72.0 | -81.54, 10.65 | 291.54, 92.93 | -56.77, -30.5 | in-in | in | 8.6221 | Saltbr-in | 2.758 | HRD-in | -85.79, -43.85 | 66.49, 5.16 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8379 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.4, 148.67 | APE9-dihe-na | 124.7, 168.17 | APE8-dihe-in | -75.56, 128.13 | APE8-rot-in | 303.25 | APE67-dihe-in | -73.59, -25.55 | -47.62, -47.17 | APE12-dist-in | 8.8934 | APE11-dist-in | 11.6597 | APE10-dist-in | 5.9505 | APE9-dist-in | 3.2463 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 274.0 | 274.0 | 0 | 28 | 28 | 0 | [[16, 273]] | 1.0 | AF-Q8IVH8-K3 | STE_MAP4K3_HUMAN | STE | 4.8e-100 | 340.1 | 1.0 | 257.0 | 257.0 | 153 | 154 | 155 | 157 | 159 | 45 | 61 | 65 | 133 | 135 | 134 | 136.0 | 196 | 181 | 176 | 175 | 174 | 173 | 172 | 171 | 170 | 91 | Mitogen-activated protein kinase kinase kinase kinase 3 |
| 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 | MAP4K3 | M4K3_HUMAN | AF-Q8IVH8-K1A | Q8IVH8 | 8 | 281 | 894.0 | No_ligand | No_ligand | Active | DFGin | 6.0587 | 13.8866 | BLAminus | -135.09, 176.01 | 60.66, 69.27 | -88.36, 10.08 | 297.84, 97.93 | -55.05, -43.84 | in-in | in | 8.0711 | Saltbr-in | 2.7199 | HRD-in | -86.04, -45.82 | 66.69, 5.33 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8691 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -149.39, 153.76 | APE9-dihe-na | 120.56, 171.92 | APE8-dihe-in | -77.71, 132.65 | APE8-rot-in | 305.52 | APE67-dihe-inflip | 73.55, -40.51 | -49.39, 160.24 | APE12-dist-in | 8.6508 | APE11-dist-in | 11.6998 | APE10-dist-in | 5.9401 | APE9-dist-in | 3.4578 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 274.0 | 274.0 | 0 | 28 | 28 | 0 | [[16, 273]] | 1.0 | AF-Q8IVH8-K1 | Homo sapiens | STE_MAP4K3_HUMAN | STE | 4.8e-100 | 340.1 | 1.0 | 257.0 | 257.0 | 153 | 154 | 155 | 157 | 159 | 45 | 61 | 65 | 133 | 135 | 134 | 136.0 | 196 | 181 | 176 | 175 | 174 | 173 | 172 | 171 | 170 | 91 | Mitogen-activated protein kinase kinase kinase kinase 3 |
| STE | MAP4K3 | M4K3_HUMAN | AF-Q8IVH8-K3A | Q8IVH8 | 8 | 281 | 894.0 | No_ligand | No_ligand | Active | DFGin | 5.9406 | 14.1137 | BLAminus | -134.97, 173.95 | 56.18, 72.0 | -81.54, 10.65 | 291.54, 92.93 | -56.77, -30.5 | in-in | in | 8.6221 | Saltbr-in | 2.758 | HRD-in | -85.79, -43.85 | 66.49, 5.16 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8379 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.4, 148.67 | APE9-dihe-na | 124.7, 168.17 | APE8-dihe-in | -75.56, 128.13 | APE8-rot-in | 303.25 | APE67-dihe-in | -73.59, -25.55 | -47.62, -47.17 | APE12-dist-in | 8.8934 | APE11-dist-in | 11.6597 | APE10-dist-in | 5.9505 | APE9-dist-in | 3.2463 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 274.0 | 274.0 | 0 | 28 | 28 | 0 | [[16, 273]] | 1.0 | AF-Q8IVH8-K3 | Homo sapiens | STE_MAP4K3_HUMAN | STE | 4.8e-100 | 340.1 | 1.0 | 257.0 | 257.0 | 153 | 154 | 155 | 157 | 159 | 45 | 61 | 65 | 133 | 135 | 134 | 136.0 | 196 | 181 | 176 | 175 | 174 | 173 | 172 | 171 | 170 | 91 | Mitogen-activated protein kinase kinase kinase kinase 3 |
| 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 |
|---|