| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TYR | LCK | LCK_HUMAN | AF-P06239-K1A | P06239 | 237 | 504 | 509.0 | No_ligand | No_ligand | Active | DFGin | 6.328 | 14.1526 | BLAminus | -126.04, -170.13 | 45.11, 68.26 | -81.31, 13.89 | 294.73, 92.3 | -58.95, -32.04 | in-in | in | 7.9598 | Saltbr-in | 2.6433 | HRD-in | -85.36, -45.83 | 65.94, -10.17 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8976 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -106.19, 136.15 | APE9-dihe-in | -124.27, 155.23 | APE8-dihe-in | -71.92, 86.36 | APE8-rot-na | 31.24 | APE67-dihe-in | -69.87, -19.44 | -40.13, -40.16 | APE12-dist-na | 14.8773 | APE11-dist-na | 10.0813 | APE10-dist-na | 12.4867 | APE9-dist-in | 6.7323 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268.0 | 268.0 | 0 | 29 | 29 | 0 | [[245, 496]] | 1.0 | AF-P06239-K1 | TYR_LCK_HUMAN | TYR | 1.2e-94 | 322.4 | 1.0 | 260.0 | 260.0 | 381 | 382 | 383 | 385 | 387 | 273 | 288 | 292 | 361 | 363 | 362 | 364.0 | 422 | 410 | 405 | 404 | 403 | 402 | 401 | 400 | 399 | 317 | Tyrosine-protein kinase Lck |
| TYR | LCK | LCK_HUMAN | AF-P06239-K3A | P06239 | 237 | 504 | 509.0 | No_ligand | No_ligand | Active | DFGin | 6.2935 | 13.7833 | BLAminus | -134.52, -177.41 | 60.79, 49.52 | -69.07, 12.08 | 301.31, 98.31 | -58.6, -28.96 | in-in | in | 7.9756 | Saltbr-in | 2.772 | HRD-in | -89.57, -43.32 | 67.76, -6.71 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8754 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -99.73, 134.23 | APE9-dihe-in | -125.84, 153.44 | APE8-dihe-in | -76.15, 84.49 | APE8-rot-na | 34.38 | APE67-dihe-in | -65.31, -15.47 | -42.39, -42.12 | APE12-dist-na | 14.5862 | APE11-dist-na | 9.8547 | APE10-dist-na | 11.5566 | APE9-dist-in | 6.4588 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268.0 | 268.0 | 0 | 29 | 29 | 0 | [[245, 496]] | 1.0 | AF-P06239-K3 | TYR_LCK_HUMAN | TYR | 1.2e-94 | 322.4 | 1.0 | 260.0 | 260.0 | 381 | 382 | 383 | 385 | 387 | 273 | 288 | 292 | 361 | 363 | 362 | 364.0 | 422 | 410 | 405 | 404 | 403 | 402 | 401 | 400 | 399 | 317 | Tyrosine-protein kinase Lck |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TYR | LCK | LCK_HUMAN | AF-P06239-K1A | P06239 | 237 | 504 | 509.0 | No_ligand | No_ligand | Active | DFGin | 6.328 | 14.1526 | BLAminus | -126.04, -170.13 | 45.11, 68.26 | -81.31, 13.89 | 294.73, 92.3 | -58.95, -32.04 | in-in | in | 7.9598 | Saltbr-in | 2.6433 | HRD-in | -85.36, -45.83 | 65.94, -10.17 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8976 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -106.19, 136.15 | APE9-dihe-in | -124.27, 155.23 | APE8-dihe-in | -71.92, 86.36 | APE8-rot-na | 31.24 | APE67-dihe-in | -69.87, -19.44 | -40.13, -40.16 | APE12-dist-na | 14.8773 | APE11-dist-na | 10.0813 | APE10-dist-na | 12.4867 | APE9-dist-in | 6.7323 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268.0 | 268.0 | 0 | 29 | 29 | 0 | [[245, 496]] | 1.0 | AF-P06239-K1 | Homo sapiens | TYR_LCK_HUMAN | TYR | 1.2e-94 | 322.4 | 1.0 | 260.0 | 260.0 | 381 | 382 | 383 | 385 | 387 | 273 | 288 | 292 | 361 | 363 | 362 | 364.0 | 422 | 410 | 405 | 404 | 403 | 402 | 401 | 400 | 399 | 317 | Tyrosine-protein kinase Lck |
| TYR | LCK | LCK_HUMAN | AF-P06239-K3A | P06239 | 237 | 504 | 509.0 | No_ligand | No_ligand | Active | DFGin | 6.2935 | 13.7833 | BLAminus | -134.52, -177.41 | 60.79, 49.52 | -69.07, 12.08 | 301.31, 98.31 | -58.6, -28.96 | in-in | in | 7.9756 | Saltbr-in | 2.772 | HRD-in | -89.57, -43.32 | 67.76, -6.71 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8754 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -99.73, 134.23 | APE9-dihe-in | -125.84, 153.44 | APE8-dihe-in | -76.15, 84.49 | APE8-rot-na | 34.38 | APE67-dihe-in | -65.31, -15.47 | -42.39, -42.12 | APE12-dist-na | 14.5862 | APE11-dist-na | 9.8547 | APE10-dist-na | 11.5566 | APE9-dist-in | 6.4588 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268.0 | 268.0 | 0 | 29 | 29 | 0 | [[245, 496]] | 1.0 | AF-P06239-K3 | Homo sapiens | TYR_LCK_HUMAN | TYR | 1.2e-94 | 322.4 | 1.0 | 260.0 | 260.0 | 381 | 382 | 383 | 385 | 387 | 273 | 288 | 292 | 361 | 363 | 362 | 364.0 | 422 | 410 | 405 | 404 | 403 | 402 | 401 | 400 | 399 | 317 | Tyrosine-protein kinase Lck |
| 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 |
|---|