| Gene | 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| PBK | AF-Q96KB5-K1A | Q96KB5 | 24 | 322 | 322.0 | No_ligand | No_ligand | Active | DFGin | 5.994 | 13.3274 | BLAminus | -130.77, 175.32 | 61.95, 66.54 | -79.12, 21.11 | 301.93, 999.0 | -68.13, -16.97 | in-in | in | 7.7011 | Saltbr-in | 2.7698 | HRD-in | -66.38, -50.09 | 86.37, -1.71 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8076 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -80.87, -59.74 | APE9-dihe-na | 54.35, -173.14 | APE8-dihe-in | -118.19, 132.59 | APE8-rot-in | 302.93 | APE67-dihe-in | -61.14, -23.31 | -48.42, -50.72 | APE12-dist-in | 9.2505 | APE11-dist-in | 8.9377 | APE10-dist-in | 5.681 | APE9-dist-in | 3.2008 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 299.0 | 299.0 | 0 | 31 | 31 | 0 | [[32, 320]] | 1.0 | AF-Q96KB5-K1 | OTHER_PBK_HUMAN | TKL | 8.7e-42 | 149.4 | 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 |
| PBK | AF-Q96KB5-K3A | Q96KB5 | 24 | 322 | 322.0 | No_ligand | No_ligand | Active | DFGin | 5.9828 | 13.2756 | BLAminus | -134.86, 175.35 | 64.16, 62.22 | -75.68, 21.4 | 299.34, 999.0 | -72.93, -12.09 | in-in | in | 7.744 | Saltbr-in | 2.8207 | HRD-in | -68.53, -48.41 | 78.67, 9.77 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8683 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -74.76, -63.28 | APE9-dihe-na | 49.29, -168.42 | APE8-dihe-in | -120.47, 133.05 | APE8-rot-in | 307.14 | APE67-dihe-in | -58.71, -21.68 | -53.0, -49.72 | APE12-dist-in | 9.5059 | APE11-dist-in | 8.934 | APE10-dist-in | 5.491 | APE9-dist-in | 3.1601 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 299.0 | 299.0 | 0 | 31 | 31 | 0 | [[32, 320]] | 1.0 | AF-Q96KB5-K3 | OTHER_PBK_HUMAN | TKL | 8.7e-42 | 149.4 | 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 |
| PBK | 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 |
| PBK | 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 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| PBK | TOPK_HUMAN | AF-Q96KB5-K1A | Q96KB5 | 24 | 322 | 322.0 | No_ligand | No_ligand | Active | DFGin | 5.994 | 13.3274 | BLAminus | -130.77, 175.32 | 61.95, 66.54 | -79.12, 21.11 | 301.93, 999.0 | -68.13, -16.97 | in-in | in | 7.7011 | Saltbr-in | 2.7698 | HRD-in | -66.38, -50.09 | 86.37, -1.71 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8076 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -80.87, -59.74 | APE9-dihe-na | 54.35, -173.14 | APE8-dihe-in | -118.19, 132.59 | APE8-rot-in | 302.93 | APE67-dihe-in | -61.14, -23.31 | -48.42, -50.72 | APE12-dist-in | 9.2505 | APE11-dist-in | 8.9377 | APE10-dist-in | 5.681 | APE9-dist-in | 3.2008 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 299.0 | 299.0 | 0 | 31 | 31 | 0 | [[32, 320]] | 1.0 | AF-Q96KB5-K1 | Homo sapiens | OTHER_PBK_HUMAN | TKL | 8.7e-42 | 149.4 | 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 |
| PBK | TOPK_HUMAN | AF-Q96KB5-K3A | Q96KB5 | 24 | 322 | 322.0 | No_ligand | No_ligand | Active | DFGin | 5.9828 | 13.2756 | BLAminus | -134.86, 175.35 | 64.16, 62.22 | -75.68, 21.4 | 299.34, 999.0 | -72.93, -12.09 | in-in | in | 7.744 | Saltbr-in | 2.8207 | HRD-in | -68.53, -48.41 | 78.67, 9.77 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8683 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -74.76, -63.28 | APE9-dihe-na | 49.29, -168.42 | APE8-dihe-in | -120.47, 133.05 | APE8-rot-in | 307.14 | APE67-dihe-in | -58.71, -21.68 | -53.0, -49.72 | APE12-dist-in | 9.5059 | APE11-dist-in | 8.934 | APE10-dist-in | 5.491 | APE9-dist-in | 3.1601 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 299.0 | 299.0 | 0 | 31 | 31 | 0 | [[32, 320]] | 1.0 | AF-Q96KB5-K3 | Homo sapiens | OTHER_PBK_HUMAN | TKL | 8.7e-42 | 149.4 | 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 |
| 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 |
| 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 |
|---|
| 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 |
|---|