| 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 | 6RNAA | O43353 | 5 | 310 | 540.0 | KA2:401 | Type1.5_Back | Inactive | DFGin | 6.0963 | 14.1187 | BLAminus | -118.69, -178.94 | 59.47, 86.33 | -104.16, 26.83 | 288.87, 81.14 | -69.66, -36.26 | in-in | in | 8.0213 | Saltbr-in | 2.8713 | HRD-in | -59.8, -53.12 | 61.06, 18.18 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.806 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnoo | APE10-dihe-na | 999.0, -150.26 | APE9-dihe-na | -111.81, -125.99 | APE8-dihe-in | -71.22, 149.14 | APE8-rot-out | 191.73 | APE67-dihe-in | -63.27, -18.82 | -116.66, -2.39 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 10.3587 | APE9-dist-out | 10.6079 | None | None | None | XRAY | 2.62 | 0.162 | 0.19 | A | 311.0 | 277.0 | 29 | 33 | 19 | 14 | [[18, 292]] | 1.0 | 6rna | TKL_RIPK2_HUMAN | TKL | 4.5e-73 | 252.0 | 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 | 6RNAB | O43353 | 4 | 310 | 540.0 | KA2:401 | Type1.5_Back | Inactive | DFGin | 6.0802 | 14.2468 | BLAminus | -120.18, -176.72 | 60.07, 86.2 | -105.54, 23.51 | 290.08, 82.68 | -62.84, -38.47 | in-in | in | 8.0698 | Saltbr-in | 3.2503 | HRD-in | -61.33, -52.71 | 61.11, 15.17 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8167 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nioo | APE10-dihe-na | -137.02, 170.76 | APE9-dihe-na | -116.32, -128.61 | APE8-dihe-in | -67.14, 150.22 | APE8-rot-out | 193.81 | APE67-dihe-in | -62.73, -17.87 | -118.35, -1.43 | APE12-dist-none | 999.0 | APE11-dist-in | 11.9097 | APE10-dist-out | 10.6231 | APE9-dist-out | 11.1029 | None | None | None | XRAY | 2.62 | 0.162 | 0.19 | B | 311.0 | 284.0 | 23 | 33 | 20 | 13 | [[18, 292]] | 1.0 | 6rna | TKL_RIPK2_HUMAN | TKL | 4.5e-73 | 252.0 | 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 | 6RNAA | O43353 | 5 | 310 | 540.0 | KA2:401 | Type1.5_Back | Inactive | DFGin | 6.0963 | 14.1187 | BLAminus | -118.69, -178.94 | 59.47, 86.33 | -104.16, 26.83 | 288.87, 81.14 | -69.66, -36.26 | in-in | in | 8.0213 | Saltbr-in | 2.8713 | HRD-in | -59.8, -53.12 | 61.06, 18.18 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.806 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnoo | APE10-dihe-na | 999.0, -150.26 | APE9-dihe-na | -111.81, -125.99 | APE8-dihe-in | -71.22, 149.14 | APE8-rot-out | 191.73 | APE67-dihe-in | -63.27, -18.82 | -116.66, -2.39 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 10.3587 | APE9-dist-out | 10.6079 | None | None | None | XRAY | 2.62 | 0.162 | 0.19 | A | 311.0 | 277.0 | 29 | 33 | 19 | 14 | [[18, 292]] | 1.0 | 6rna | Homo sapiens | TKL_RIPK2_HUMAN | TKL | 4.5e-73 | 252.0 | 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 | 6RNAB | O43353 | 4 | 310 | 540.0 | KA2:401 | Type1.5_Back | Inactive | DFGin | 6.0802 | 14.2468 | BLAminus | -120.18, -176.72 | 60.07, 86.2 | -105.54, 23.51 | 290.08, 82.68 | -62.84, -38.47 | in-in | in | 8.0698 | Saltbr-in | 3.2503 | HRD-in | -61.33, -52.71 | 61.11, 15.17 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8167 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nioo | APE10-dihe-na | -137.02, 170.76 | APE9-dihe-na | -116.32, -128.61 | APE8-dihe-in | -67.14, 150.22 | APE8-rot-out | 193.81 | APE67-dihe-in | -62.73, -17.87 | -118.35, -1.43 | APE12-dist-none | 999.0 | APE11-dist-in | 11.9097 | APE10-dist-out | 10.6231 | APE9-dist-out | 11.1029 | None | None | None | XRAY | 2.62 | 0.162 | 0.19 | B | 311.0 | 284.0 | 23 | 33 | 20 | 13 | [[18, 292]] | 1.0 | 6rna | Homo sapiens | TKL_RIPK2_HUMAN | TKL | 4.5e-73 | 252.0 | 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 |
|---|