| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| OTHER | PBK | TOPK_HUMAN | 5J0AA | Q96KB5 | 23 | 320 | 322.0 | No_ligand | No_ligand | Inactive | DFGin | 6.8067 | 27.4929 | BLBtrans | -120.83, 178.23 | 63.13, 46.26 | -77.68, 127.34 | 174.11, 999.0 | -94.63, -173.86 | out-out | out | 23.4969 | Saltbr-out | 22.2451 | HRD-in | -63.25, -61.27 | 89.24, -1.01 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.7594 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -135.7, -53.99 | APE9-dihe-na | 50.9, -150.82 | APE8-dihe-in | -122.3, 115.82 | APE8-rot-in | 307.93 | APE67-dihe-in | -53.08, -19.22 | -17.72, -67.97 | APE12-dist-in | 12.6266 | APE11-dist-in | 12.5688 | APE10-dist-out | 13.0977 | APE9-dist-in | 3.0357 | T198E | None | None | XRAY | 2.74 | 0.222 | 0.271 | A | 300.0 | 298.0 | 0 | 31 | 31 | 0 | [[32, 320]] | 1.0 | 5j0a | OTHER_PBK_HUMAN | TKL | 7.2e-42 | 149.6 | 5.0 | 266.0 | 262.0 | 185 | 186 | 187 | 189 | 191 | 64 | 85 | 89 | 164 | 166 | 165 | 167.0 | 229 | 216 | 211 | 210 | 209 | 208 | 207 | 206 | 205 | 116 | Lymphokine-activated killer T-cell-originated protein kinase |
| OTHER | PBK | TOPK_HUMAN | 5J0AB | Q96KB5 | 19 | 319 | 322.0 | No_ligand | No_ligand | Inactive | DFGin | 6.8824 | 26.8425 | BLBtrans | -128.2, 177.09 | 70.09, 37.25 | -75.07, 133.1 | 177.1, 999.0 | -120.74, -176.84 | out-out | out | 22.7171 | Saltbr-out | 18.5308 | HRD-in | -62.17, -46.14 | 110.68, -48.17 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9774 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -119.14, -51.77 | APE9-dihe-na | 53.77, -148.64 | APE8-dihe-in | -130.26, 121.96 | APE8-rot-in | 308.15 | APE67-dihe-in | -51.55, -28.41 | -28.76, -64.16 | APE12-dist-in | 12.0509 | APE11-dist-in | 12.6318 | APE10-dist-out | 13.0495 | APE9-dist-in | 3.4432 | T198E | None | None | XRAY | 2.74 | 0.222 | 0.271 | B | 304.0 | 301.0 | 0 | 31 | 31 | 0 | [[32, 320]] | 1.0 | 5j0a | OTHER_PBK_HUMAN | TKL | 7.3e-42 | 149.6 | 5.0 | 266.0 | 262.0 | 185 | 186 | 187 | 189 | 191 | 64 | 85 | 89 | 164 | 166 | 165 | 167.0 | 229 | 216 | 211 | 210 | 209 | 208 | 207 | 206 | 205 | 116 | Lymphokine-activated killer T-cell-originated protein kinase |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| OTHER | PBK | TOPK_HUMAN | 5J0AA | Q96KB5 | 23 | 320 | 322.0 | No_ligand | No_ligand | Inactive | DFGin | 6.8067 | 27.4929 | BLBtrans | -120.83, 178.23 | 63.13, 46.26 | -77.68, 127.34 | 174.11, 999.0 | -94.63, -173.86 | out-out | out | 23.4969 | Saltbr-out | 22.2451 | HRD-in | -63.25, -61.27 | 89.24, -1.01 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.7594 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -135.7, -53.99 | APE9-dihe-na | 50.9, -150.82 | APE8-dihe-in | -122.3, 115.82 | APE8-rot-in | 307.93 | APE67-dihe-in | -53.08, -19.22 | -17.72, -67.97 | APE12-dist-in | 12.6266 | APE11-dist-in | 12.5688 | APE10-dist-out | 13.0977 | APE9-dist-in | 3.0357 | T198E | None | None | XRAY | 2.74 | 0.222 | 0.271 | A | 300.0 | 298.0 | 0 | 31 | 31 | 0 | [[32, 320]] | 1.0 | 5j0a | Homo sapiens | OTHER_PBK_HUMAN | TKL | 7.2e-42 | 149.6 | 5.0 | 266.0 | 262.0 | 185 | 186 | 187 | 189 | 191 | 64 | 85 | 89 | 164 | 166 | 165 | 167.0 | 229 | 216 | 211 | 210 | 209 | 208 | 207 | 206 | 205 | 116 | Lymphokine-activated killer T-cell-originated protein kinase |
| OTHER | PBK | TOPK_HUMAN | 5J0AB | Q96KB5 | 19 | 319 | 322.0 | No_ligand | No_ligand | Inactive | DFGin | 6.8824 | 26.8425 | BLBtrans | -128.2, 177.09 | 70.09, 37.25 | -75.07, 133.1 | 177.1, 999.0 | -120.74, -176.84 | out-out | out | 22.7171 | Saltbr-out | 18.5308 | HRD-in | -62.17, -46.14 | 110.68, -48.17 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9774 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -119.14, -51.77 | APE9-dihe-na | 53.77, -148.64 | APE8-dihe-in | -130.26, 121.96 | APE8-rot-in | 308.15 | APE67-dihe-in | -51.55, -28.41 | -28.76, -64.16 | APE12-dist-in | 12.0509 | APE11-dist-in | 12.6318 | APE10-dist-out | 13.0495 | APE9-dist-in | 3.4432 | T198E | None | None | XRAY | 2.74 | 0.222 | 0.271 | B | 304.0 | 301.0 | 0 | 31 | 31 | 0 | [[32, 320]] | 1.0 | 5j0a | Homo sapiens | OTHER_PBK_HUMAN | TKL | 7.3e-42 | 149.6 | 5.0 | 266.0 | 262.0 | 185 | 186 | 187 | 189 | 191 | 64 | 85 | 89 | 164 | 166 | 165 | 167.0 | 229 | 216 | 211 | 210 | 209 | 208 | 207 | 206 | 205 | 116 | Lymphokine-activated killer T-cell-originated protein kinase |
| 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 |
|---|