| 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 | RIPK2 | RIPK2_HUMAN | AF-O43353-K1A | O43353 | 10 | 300 | 540.0 | No_ligand | No_ligand | Inactive | DFGin | 5.8465 | 14.0078 | BLAminus | -127.94, 175.85 | 61.05, 79.69 | -94.57, 16.88 | 285.86, 79.13 | -59.24, -35.38 | in-in | in | 8.056 | Saltbr-in | 2.7289 | HRD-in | -78.75, -47.93 | 64.43, -6.6 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8926 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_ioii | APE10-dihe-na | -61.43, 170.33 | APE9-dihe-na | 162.37, 176.49 | APE8-dihe-in | -85.18, 118.94 | APE8-rot-in | 304.26 | APE67-dihe-in | -60.83, -35.85 | -43.4, -45.78 | APE12-dist-in | 11.8663 | APE11-dist-out | 7.5907 | APE10-dist-in | 6.5108 | APE9-dist-in | 3.4941 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 291.0 | 291.0 | 0 | 33 | 33 | 0 | [[18, 292]] | 1.0 | AF-O43353-K1 | TKL_RIPK2_HUMAN | TKL | 3.5e-73 | 252.3 | 4.0 | 266.0 | 263.0 | 163 | 164 | 165 | 167 | 169 | 47 | 66 | 70 | 143 | 145 | 144 | 146.0 | 211 | 196 | 191 | 190 | 189 | 188 | 187 | 186 | 185 | 96 | Receptor-interacting serine/threonine-protein kinase 2 |
| TKL | RIPK2 | RIPK2_HUMAN | AF-O43353-K3A | O43353 | 10 | 300 | 540.0 | No_ligand | No_ligand | Active | DFGin | 5.8355 | 13.9164 | BLAminus | -131.05, 176.49 | 59.07, 72.73 | -86.61, 15.53 | 288.91, 79.18 | -58.82, -34.9 | in-in | in | 8.0725 | Saltbr-in | 2.7454 | HRD-in | -79.76, -41.87 | 62.78, -13.47 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8929 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -60.31, 147.35 | APE9-dihe-na | 163.97, 163.66 | APE8-dihe-in | -80.92, 119.55 | APE8-rot-in | 303.11 | APE67-dihe-in | -58.79, -31.16 | -43.37, -46.06 | APE12-dist-in | 12.1519 | APE11-dist-in | 8.6903 | APE10-dist-in | 6.3862 | APE9-dist-in | 3.8157 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 291.0 | 291.0 | 0 | 33 | 33 | 0 | [[18, 292]] | 1.0 | AF-O43353-K3 | TKL_RIPK2_HUMAN | TKL | 3.5e-73 | 252.3 | 4.0 | 266.0 | 263.0 | 163 | 164 | 165 | 167 | 169 | 47 | 66 | 70 | 143 | 145 | 144 | 146.0 | 211 | 196 | 191 | 190 | 189 | 188 | 187 | 186 | 185 | 96 | Receptor-interacting serine/threonine-protein kinase 2 |
| 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 | RIPK2 | RIPK2_HUMAN | AF-O43353-K1A | O43353 | 10 | 300 | 540.0 | No_ligand | No_ligand | Inactive | DFGin | 5.8465 | 14.0078 | BLAminus | -127.94, 175.85 | 61.05, 79.69 | -94.57, 16.88 | 285.86, 79.13 | -59.24, -35.38 | in-in | in | 8.056 | Saltbr-in | 2.7289 | HRD-in | -78.75, -47.93 | 64.43, -6.6 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8926 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_ioii | APE10-dihe-na | -61.43, 170.33 | APE9-dihe-na | 162.37, 176.49 | APE8-dihe-in | -85.18, 118.94 | APE8-rot-in | 304.26 | APE67-dihe-in | -60.83, -35.85 | -43.4, -45.78 | APE12-dist-in | 11.8663 | APE11-dist-out | 7.5907 | APE10-dist-in | 6.5108 | APE9-dist-in | 3.4941 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 291.0 | 291.0 | 0 | 33 | 33 | 0 | [[18, 292]] | 1.0 | AF-O43353-K1 | Homo sapiens | TKL_RIPK2_HUMAN | TKL | 3.5e-73 | 252.3 | 4.0 | 266.0 | 263.0 | 163 | 164 | 165 | 167 | 169 | 47 | 66 | 70 | 143 | 145 | 144 | 146.0 | 211 | 196 | 191 | 190 | 189 | 188 | 187 | 186 | 185 | 96 | Receptor-interacting serine/threonine-protein kinase 2 |
| TKL | RIPK2 | RIPK2_HUMAN | AF-O43353-K3A | O43353 | 10 | 300 | 540.0 | No_ligand | No_ligand | Active | DFGin | 5.8355 | 13.9164 | BLAminus | -131.05, 176.49 | 59.07, 72.73 | -86.61, 15.53 | 288.91, 79.18 | -58.82, -34.9 | in-in | in | 8.0725 | Saltbr-in | 2.7454 | HRD-in | -79.76, -41.87 | 62.78, -13.47 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8929 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -60.31, 147.35 | APE9-dihe-na | 163.97, 163.66 | APE8-dihe-in | -80.92, 119.55 | APE8-rot-in | 303.11 | APE67-dihe-in | -58.79, -31.16 | -43.37, -46.06 | APE12-dist-in | 12.1519 | APE11-dist-in | 8.6903 | APE10-dist-in | 6.3862 | APE9-dist-in | 3.8157 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 291.0 | 291.0 | 0 | 33 | 33 | 0 | [[18, 292]] | 1.0 | AF-O43353-K3 | Homo sapiens | TKL_RIPK2_HUMAN | TKL | 3.5e-73 | 252.3 | 4.0 | 266.0 | 263.0 | 163 | 164 | 165 | 167 | 169 | 47 | 66 | 70 | 143 | 145 | 144 | 146.0 | 211 | 196 | 191 | 190 | 189 | 188 | 187 | 186 | 185 | 96 | Receptor-interacting serine/threonine-protein kinase 2 |
| 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 |
|---|