| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | RIPK3 | RIPK3_HUMAN | AF-Q9Y572-K1A | Q9Y572 | 13 | 293 | 518.0 | No_ligand | No_ligand | Active | DFGin | 6.1841 | 14.1071 | BLAminus | -136.64, 175.02 | 56.98, 73.57 | -88.11, 18.5 | 298.3, 99.24 | -61.96, -29.73 | in-in | in | 8.2485 | Saltbr-in | 2.6925 | HRD-in | -72.03, -44.39 | 65.31, -2.99 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0657 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -86.86, 138.33 | APE9-dihe-na | 114.87, 169.56 | APE8-dihe-in | -80.98, 116.64 | APE8-rot-in | 302.32 | APE67-dihe-in | -59.85, -33.44 | -51.1, -38.34 | APE12-dist-in | 12.498 | APE11-dist-in | 11.5437 | APE10-dist-in | 6.9311 | APE9-dist-in | 3.6454 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 281.0 | 281.0 | 0 | 30 | 30 | 0 | [[21, 285]] | 1.0 | AF-Q9Y572-K1 | TKL_RIPK3_HUMAN | TKL | 7.5e-66 | 228.3 | 1.0 | 265.0 | 265.0 | 159 | 160 | 161 | 163 | 165 | 50 | 60 | 64 | 139 | 141 | 140 | 142.0 | 203 | 189 | 184 | 183 | 182 | 181 | 180 | 179 | 178 | 95 | Receptor-interacting serine/threonine-protein kinase 3 |
| TKL | RIPK3 | RIPK3_HUMAN | AF-Q9Y572-K3A | Q9Y572 | 13 | 293 | 518.0 | No_ligand | No_ligand | Active | DFGin | 6.145 | 14.1327 | BLAminus | -139.86, 178.44 | 59.43, 59.33 | -73.59, 12.29 | 294.86, 96.09 | -62.88, -23.79 | in-in | in | 8.3438 | Saltbr-in | 2.7159 | HRD-in | -76.12, -45.4 | 67.85, -8.25 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9057 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -58.57, 128.0 | APE9-dihe-na | 142.75, 179.47 | APE8-dihe-in | -91.29, 123.75 | APE8-rot-in | 303.6 | APE67-dihe-in | -72.46, -18.07 | -52.04, -36.41 | APE12-dist-in | 11.8654 | APE11-dist-in | 11.0148 | APE10-dist-in | 6.6475 | APE9-dist-in | 3.6995 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 281.0 | 281.0 | 0 | 30 | 30 | 0 | [[21, 285]] | 1.0 | AF-Q9Y572-K3 | TKL_RIPK3_HUMAN | TKL | 7.5e-66 | 228.3 | 1.0 | 265.0 | 265.0 | 159 | 160 | 161 | 163 | 165 | 50 | 60 | 64 | 139 | 141 | 140 | 142.0 | 203 | 189 | 184 | 183 | 182 | 181 | 180 | 179 | 178 | 95 | Receptor-interacting serine/threonine-protein 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | RIPK3 | RIPK3_HUMAN | AF-Q9Y572-K1A | Q9Y572 | 13 | 293 | 518.0 | No_ligand | No_ligand | Active | DFGin | 6.1841 | 14.1071 | BLAminus | -136.64, 175.02 | 56.98, 73.57 | -88.11, 18.5 | 298.3, 99.24 | -61.96, -29.73 | in-in | in | 8.2485 | Saltbr-in | 2.6925 | HRD-in | -72.03, -44.39 | 65.31, -2.99 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0657 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -86.86, 138.33 | APE9-dihe-na | 114.87, 169.56 | APE8-dihe-in | -80.98, 116.64 | APE8-rot-in | 302.32 | APE67-dihe-in | -59.85, -33.44 | -51.1, -38.34 | APE12-dist-in | 12.498 | APE11-dist-in | 11.5437 | APE10-dist-in | 6.9311 | APE9-dist-in | 3.6454 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 281.0 | 281.0 | 0 | 30 | 30 | 0 | [[21, 285]] | 1.0 | AF-Q9Y572-K1 | Homo sapiens | TKL_RIPK3_HUMAN | TKL | 7.5e-66 | 228.3 | 1.0 | 265.0 | 265.0 | 159 | 160 | 161 | 163 | 165 | 50 | 60 | 64 | 139 | 141 | 140 | 142.0 | 203 | 189 | 184 | 183 | 182 | 181 | 180 | 179 | 178 | 95 | Receptor-interacting serine/threonine-protein kinase 3 |
| TKL | RIPK3 | RIPK3_HUMAN | AF-Q9Y572-K3A | Q9Y572 | 13 | 293 | 518.0 | No_ligand | No_ligand | Active | DFGin | 6.145 | 14.1327 | BLAminus | -139.86, 178.44 | 59.43, 59.33 | -73.59, 12.29 | 294.86, 96.09 | -62.88, -23.79 | in-in | in | 8.3438 | Saltbr-in | 2.7159 | HRD-in | -76.12, -45.4 | 67.85, -8.25 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9057 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -58.57, 128.0 | APE9-dihe-na | 142.75, 179.47 | APE8-dihe-in | -91.29, 123.75 | APE8-rot-in | 303.6 | APE67-dihe-in | -72.46, -18.07 | -52.04, -36.41 | APE12-dist-in | 11.8654 | APE11-dist-in | 11.0148 | APE10-dist-in | 6.6475 | APE9-dist-in | 3.6995 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 281.0 | 281.0 | 0 | 30 | 30 | 0 | [[21, 285]] | 1.0 | AF-Q9Y572-K3 | Homo sapiens | TKL_RIPK3_HUMAN | TKL | 7.5e-66 | 228.3 | 1.0 | 265.0 | 265.0 | 159 | 160 | 161 | 163 | 165 | 50 | 60 | 64 | 139 | 141 | 140 | 142.0 | 203 | 189 | 184 | 183 | 182 | 181 | 180 | 179 | 178 | 95 | Receptor-interacting serine/threonine-protein 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 |
|---|