| 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 | TESK2 | TESK2_HUMAN | AF-Q96S53-K1A | Q96S53 | 48 | 319 | 571.0 | No_ligand | No_ligand | Active | DFGin | 6.8875 | 13.6714 | BLAminus | -137.13, 172.12 | 63.94, 75.39 | -88.64, 20.96 | 307.25, 102.34 | -62.89, -26.46 | in-in | in | 8.9546 | Saltbr-in | 3.1779 | HRD-in | -78.65, -45.26 | 65.25, -9.26 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0364 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -143.3, 161.6 | APE9-dihe-na | 118.42, -176.88 | APE8-dihe-in | -91.92, 114.34 | APE8-rot-in | 298.07 | APE67-dihe-in | -68.2, -24.23 | -50.53, -38.07 | APE12-dist-in | 9.5312 | APE11-dist-in | 11.8986 | APE10-dist-in | 6.1507 | APE9-dist-in | 3.4224 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 272.0 | 272.0 | 0 | 30 | 30 | 0 | [[54, 311]] | 1.0 | AF-Q96S53-K1 | TKL_TESK2_HUMAN | TKL | 1.3e-68 | 237.5 | 5.0 | 267.0 | 263.0 | 196 | 197 | 198 | 200 | 202 | 87 | 101 | 105 | 173 | 175 | 174 | 176.0 | 238 | 226 | 221 | 220 | 219 | 218 | 217 | 216 | 215 | 131 | Dual specificity testis-specific protein kinase 2 |
| TKL | TESK2 | TESK2_HUMAN | AF-Q96S53-K3A | Q96S53 | 48 | 319 | 571.0 | No_ligand | No_ligand | Active | DFGin | 6.5714 | 13.788 | BLAminus | -136.63, 173.87 | 60.18, 76.31 | -87.58, 22.46 | 305.61, 100.37 | -61.5, -30.04 | in-in | in | 8.6442 | Saltbr-in | 2.9057 | HRD-in | -79.6, -43.96 | 65.43, -6.08 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9736 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -147.68, 160.6 | APE9-dihe-na | 120.6, -173.15 | APE8-dihe-in | -94.61, 120.26 | APE8-rot-in | 296.18 | APE67-dihe-in | -69.67, -21.42 | -51.99, -42.31 | APE12-dist-in | 9.6712 | APE11-dist-in | 11.7321 | APE10-dist-in | 5.9884 | APE9-dist-in | 3.3439 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 272.0 | 272.0 | 0 | 30 | 30 | 0 | [[54, 311]] | 1.0 | AF-Q96S53-K3 | TKL_TESK2_HUMAN | TKL | 1.3e-68 | 237.5 | 5.0 | 267.0 | 263.0 | 196 | 197 | 198 | 200 | 202 | 87 | 101 | 105 | 173 | 175 | 174 | 176.0 | 238 | 226 | 221 | 220 | 219 | 218 | 217 | 216 | 215 | 131 | Dual specificity testis-specific 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 | TESK2 | TESK2_HUMAN | AF-Q96S53-K1A | Q96S53 | 48 | 319 | 571.0 | No_ligand | No_ligand | Active | DFGin | 6.8875 | 13.6714 | BLAminus | -137.13, 172.12 | 63.94, 75.39 | -88.64, 20.96 | 307.25, 102.34 | -62.89, -26.46 | in-in | in | 8.9546 | Saltbr-in | 3.1779 | HRD-in | -78.65, -45.26 | 65.25, -9.26 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0364 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -143.3, 161.6 | APE9-dihe-na | 118.42, -176.88 | APE8-dihe-in | -91.92, 114.34 | APE8-rot-in | 298.07 | APE67-dihe-in | -68.2, -24.23 | -50.53, -38.07 | APE12-dist-in | 9.5312 | APE11-dist-in | 11.8986 | APE10-dist-in | 6.1507 | APE9-dist-in | 3.4224 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 272.0 | 272.0 | 0 | 30 | 30 | 0 | [[54, 311]] | 1.0 | AF-Q96S53-K1 | Homo sapiens | TKL_TESK2_HUMAN | TKL | 1.3e-68 | 237.5 | 5.0 | 267.0 | 263.0 | 196 | 197 | 198 | 200 | 202 | 87 | 101 | 105 | 173 | 175 | 174 | 176.0 | 238 | 226 | 221 | 220 | 219 | 218 | 217 | 216 | 215 | 131 | Dual specificity testis-specific protein kinase 2 |
| TKL | TESK2 | TESK2_HUMAN | AF-Q96S53-K3A | Q96S53 | 48 | 319 | 571.0 | No_ligand | No_ligand | Active | DFGin | 6.5714 | 13.788 | BLAminus | -136.63, 173.87 | 60.18, 76.31 | -87.58, 22.46 | 305.61, 100.37 | -61.5, -30.04 | in-in | in | 8.6442 | Saltbr-in | 2.9057 | HRD-in | -79.6, -43.96 | 65.43, -6.08 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9736 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -147.68, 160.6 | APE9-dihe-na | 120.6, -173.15 | APE8-dihe-in | -94.61, 120.26 | APE8-rot-in | 296.18 | APE67-dihe-in | -69.67, -21.42 | -51.99, -42.31 | APE12-dist-in | 9.6712 | APE11-dist-in | 11.7321 | APE10-dist-in | 5.9884 | APE9-dist-in | 3.3439 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 272.0 | 272.0 | 0 | 30 | 30 | 0 | [[54, 311]] | 1.0 | AF-Q96S53-K3 | Homo sapiens | TKL_TESK2_HUMAN | TKL | 1.3e-68 | 237.5 | 5.0 | 267.0 | 263.0 | 196 | 197 | 198 | 200 | 202 | 87 | 101 | 105 | 173 | 175 | 174 | 176.0 | 238 | 226 | 221 | 220 | 219 | 218 | 217 | 216 | 215 | 131 | Dual specificity testis-specific 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 |
|---|