| 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 | 5NG0A | O43353 | 6 | 300 | 540.0 | ACP:1000 | ATPlike | Inactive | DFGin | 5.8784 | 14.1777 | BLAminus | -123.27, -179.27 | 62.78, 77.58 | -93.4, 20.77 | 286.94, 75.81 | -61.85, -28.6 | in-in | in | 8.2049 | Saltbr-in | 2.7453 | HRD-in | -73.28, -52.62 | 66.02, 10.49 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8467 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 157.46 | APE8-dihe-in | -72.18, 143.02 | APE8-rot-out | 185.7 | APE67-dihe-in | -65.61, -24.81 | -104.28, 1.28 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 9.8005 | L294F | None | None | XRAY | 2.0 | 0.171 | 0.191 | A | 304.0 | 274.0 | 21 | 33 | 18 | 15 | [[18, 292]] | 1.0 | 5ng0 | TKL_RIPK2_HUMAN | TKL | 4.1e-73 | 252.1 | 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 | 5NG0B | O43353 | 5 | 299 | 540.0 | ACP:401 | ATPlike | Inactive | DFGin | 5.8866 | 14.1774 | BLAminus | -123.03, -178.96 | 62.29, 77.78 | -94.31, 21.44 | 286.41, 77.58 | -63.12, -27.82 | in-in | in | 8.1596 | Saltbr-in | 2.756 | HRD-in | -74.08, -51.77 | 69.59, 3.54 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8525 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_ioii | APE10-dihe-na | -72.33, -175.56 | APE9-dihe-na | 154.16, -172.85 | APE8-dihe-in | -105.14, 130.27 | APE8-rot-in | 300.55 | APE67-dihe-in | -61.64, -28.91 | -51.09, -46.77 | APE12-dist-in | 11.85 | APE11-dist-out | 7.4022 | APE10-dist-in | 6.0202 | APE9-dist-in | 3.3421 | L294F | None | None | XRAY | 2.0 | 0.171 | 0.191 | B | 304.0 | 282.0 | 13 | 33 | 23 | 10 | [[18, 292]] | 1.0 | 5ng0 | TKL_RIPK2_HUMAN | TKL | 4.1e-73 | 252.1 | 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 | 5NG0A | O43353 | 6 | 300 | 540.0 | ACP:1000 | ATPlike | Inactive | DFGin | 5.8784 | 14.1777 | BLAminus | -123.27, -179.27 | 62.78, 77.58 | -93.4, 20.77 | 286.94, 75.81 | -61.85, -28.6 | in-in | in | 8.2049 | Saltbr-in | 2.7453 | HRD-in | -73.28, -52.62 | 66.02, 10.49 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8467 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 157.46 | APE8-dihe-in | -72.18, 143.02 | APE8-rot-out | 185.7 | APE67-dihe-in | -65.61, -24.81 | -104.28, 1.28 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 9.8005 | L294F | None | None | XRAY | 2.0 | 0.171 | 0.191 | A | 304.0 | 274.0 | 21 | 33 | 18 | 15 | [[18, 292]] | 1.0 | 5ng0 | Homo sapiens | TKL_RIPK2_HUMAN | TKL | 4.1e-73 | 252.1 | 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 | 5NG0B | O43353 | 5 | 299 | 540.0 | ACP:401 | ATPlike | Inactive | DFGin | 5.8866 | 14.1774 | BLAminus | -123.03, -178.96 | 62.29, 77.78 | -94.31, 21.44 | 286.41, 77.58 | -63.12, -27.82 | in-in | in | 8.1596 | Saltbr-in | 2.756 | HRD-in | -74.08, -51.77 | 69.59, 3.54 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8525 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_ioii | APE10-dihe-na | -72.33, -175.56 | APE9-dihe-na | 154.16, -172.85 | APE8-dihe-in | -105.14, 130.27 | APE8-rot-in | 300.55 | APE67-dihe-in | -61.64, -28.91 | -51.09, -46.77 | APE12-dist-in | 11.85 | APE11-dist-out | 7.4022 | APE10-dist-in | 6.0202 | APE9-dist-in | 3.3421 | L294F | None | None | XRAY | 2.0 | 0.171 | 0.191 | B | 304.0 | 282.0 | 13 | 33 | 23 | 10 | [[18, 292]] | 1.0 | 5ng0 | Homo sapiens | TKL_RIPK2_HUMAN | TKL | 4.1e-73 | 252.1 | 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 |
|---|