| 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 | 7MX3B | Q9Y572 | 12 | 309 | 518.0 | ZOV:401 | Type1 | Inactive | DFGin | 6.5416 | 14.2613 | BLAminus | -142.24, -163.59 | 59.46, 56.29 | -87.14, 32.54 | 292.99, 86.32 | -63.8, -63.45 | in-out | in | 8.2134 | Saltbr-out | 3.8841 | HRD-in | -71.92, -42.98 | 73.44, -14.04 | out-in-none | SNCoin | in-none | ActLoopNT-in | 2.9397 | ActLoopCT-none | nonTYR | APEdihe_aanii | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 174.97 | APE8-rot-in | 306.5 | APE67-dihe-in | -71.82, -40.75 | -58.31, -39.26 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | C3S,C110A | None | None | XRAY | 3.23 | 0.244 | 0.285 | B | 319.0 | 269.0 | 29 | 30 | 14 | 16 | [[21, 285]] | 1.0 | 7mx3 | TKL_RIPK3_HUMAN | TKL | 7.4e-66 | 228.4 | 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 | 7MX3A | Q9Y572 | 12 | 314 | 518.0 | ZOV:401 | Type1.5_Back | None | DFGin | 6.2221 | 13.9088 | BLAminus | -152.35, -176.12 | 58.98, 65.68 | -88.59, 21.74 | 285.92, 83.22 | -75.2, -29.2 | in-in | in | 7.9672 | Saltbr-in | 2.917 | HRD-in | -70.69, -48.21 | 67.95, 8.04 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.2018 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | -69.66, -25.03 | 999.0, -33.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | C3S,C110A | None | None | XRAY | 3.23 | 0.244 | 0.285 | A | 319.0 | 292.0 | 11 | 30 | 20 | 10 | [[21, 285]] | 1.0 | 7mx3 | TKL_RIPK3_HUMAN | TKL | 7.4e-66 | 228.4 | 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 | 7MX3C | Q9Y572 | 9 | 311 | 518.0 | ZOV:401 | Type1.5_Back | None | DFGin | 6.3242 | 14.4086 | BLAminus | -144.06, -179.33 | 56.59, 66.53 | -89.63, 30.65 | 289.6, 92.66 | -94.37, -38.42 | in-in | in | 7.3677 | Saltbr-in | 3.19 | HRD-in | -62.63, -60.0 | 65.83, 13.04 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.1544 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | -60.63, -27.61 | 999.0, -44.75 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | C3S,C110A | None | None | XRAY | 3.23 | 0.244 | 0.285 | C | 319.0 | 285.0 | 18 | 30 | 20 | 10 | [[21, 285]] | 1.0 | 7mx3 | TKL_RIPK3_HUMAN | TKL | 7.4e-66 | 228.4 | 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 | 7MX3D | Q9Y572 | 12 | 311 | 518.0 | ZOV:401 | Type1.5_Back | None | DFGin | 6.1579 | 13.9338 | BLAminus | -152.67, -168.91 | 60.99, 69.08 | -93.05, 21.87 | 286.54, 121.22 | -73.96, -39.13 | in-in | in | 8.1149 | Saltbr-in | 3.2288 | HRD-in | -81.46, -31.71 | 66.32, -56.05 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9385 | ActLoopCT-none | nonTYR | APEdihe_aanii | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 153.09 | APE8-rot-in | 303.22 | APE67-dihe-in | -61.12, -38.55 | -55.88, -51.2 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | C3S,C110A | None | None | XRAY | 3.23 | 0.244 | 0.285 | D | 319.0 | 280.0 | 19 | 30 | 16 | 14 | [[21, 285]] | 1.0 | 7mx3 | TKL_RIPK3_HUMAN | TKL | 7.4e-66 | 228.4 | 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 | 7MX3B | Q9Y572 | 12 | 309 | 518.0 | ZOV:401 | Type1 | Inactive | DFGin | 6.5416 | 14.2613 | BLAminus | -142.24, -163.59 | 59.46, 56.29 | -87.14, 32.54 | 292.99, 86.32 | -63.8, -63.45 | in-out | in | 8.2134 | Saltbr-out | 3.8841 | HRD-in | -71.92, -42.98 | 73.44, -14.04 | out-in-none | SNCoin | in-none | ActLoopNT-in | 2.9397 | ActLoopCT-none | nonTYR | APEdihe_aanii | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 174.97 | APE8-rot-in | 306.5 | APE67-dihe-in | -71.82, -40.75 | -58.31, -39.26 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | C3S,C110A | None | None | XRAY | 3.23 | 0.244 | 0.285 | B | 319.0 | 269.0 | 29 | 30 | 14 | 16 | [[21, 285]] | 1.0 | 7mx3 | Homo sapiens | TKL_RIPK3_HUMAN | TKL | 7.4e-66 | 228.4 | 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 | 7MX3A | Q9Y572 | 12 | 314 | 518.0 | ZOV:401 | Type1.5_Back | None | DFGin | 6.2221 | 13.9088 | BLAminus | -152.35, -176.12 | 58.98, 65.68 | -88.59, 21.74 | 285.92, 83.22 | -75.2, -29.2 | in-in | in | 7.9672 | Saltbr-in | 2.917 | HRD-in | -70.69, -48.21 | 67.95, 8.04 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.2018 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | -69.66, -25.03 | 999.0, -33.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | C3S,C110A | None | None | XRAY | 3.23 | 0.244 | 0.285 | A | 319.0 | 292.0 | 11 | 30 | 20 | 10 | [[21, 285]] | 1.0 | 7mx3 | Homo sapiens | TKL_RIPK3_HUMAN | TKL | 7.4e-66 | 228.4 | 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 | 7MX3C | Q9Y572 | 9 | 311 | 518.0 | ZOV:401 | Type1.5_Back | None | DFGin | 6.3242 | 14.4086 | BLAminus | -144.06, -179.33 | 56.59, 66.53 | -89.63, 30.65 | 289.6, 92.66 | -94.37, -38.42 | in-in | in | 7.3677 | Saltbr-in | 3.19 | HRD-in | -62.63, -60.0 | 65.83, 13.04 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.1544 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | -60.63, -27.61 | 999.0, -44.75 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | C3S,C110A | None | None | XRAY | 3.23 | 0.244 | 0.285 | C | 319.0 | 285.0 | 18 | 30 | 20 | 10 | [[21, 285]] | 1.0 | 7mx3 | Homo sapiens | TKL_RIPK3_HUMAN | TKL | 7.4e-66 | 228.4 | 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 | 7MX3D | Q9Y572 | 12 | 311 | 518.0 | ZOV:401 | Type1.5_Back | None | DFGin | 6.1579 | 13.9338 | BLAminus | -152.67, -168.91 | 60.99, 69.08 | -93.05, 21.87 | 286.54, 121.22 | -73.96, -39.13 | in-in | in | 8.1149 | Saltbr-in | 3.2288 | HRD-in | -81.46, -31.71 | 66.32, -56.05 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9385 | ActLoopCT-none | nonTYR | APEdihe_aanii | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 153.09 | APE8-rot-in | 303.22 | APE67-dihe-in | -61.12, -38.55 | -55.88, -51.2 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | C3S,C110A | None | None | XRAY | 3.23 | 0.244 | 0.285 | D | 319.0 | 280.0 | 19 | 30 | 16 | 14 | [[21, 285]] | 1.0 | 7mx3 | Homo sapiens | TKL_RIPK3_HUMAN | TKL | 7.4e-66 | 228.4 | 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 |
|---|