| 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 | HCK | HCK_HUMAN | 3VS5A | P08631 | 81 | 526 | 526.0 | VSG:60601 | Type1 | Inactive | DFGin | 5.3025 | 12.7869 | BLBplus | -113.17, 163.39 | 44.9, 47.31 | -70.54, 124.98 | 29.01, 97.87 | 91.21, -36.02 | out-out | out | 13.8811 | Saltbr-out | 13.6733 | HRD-in | -80.1, -56.21 | 84.49, -32.57 | out-out-none | SNCoon | out-none | ActLoopNT-out | 6.9642 | ActLoopCT-none | TYR | APEdihe_nnnai | APEdist_aaan | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 999.0 | APE8-dihe-none | 999.0, 38.63 | APE8-rot-na | 346.37 | APE67-dihe-in | -64.79, -16.3 | -91.95, -10.89 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-none | 999.0 | Q523E,Q524E,Q525I | PTR522 | PTR522 | XRAY | 2.851 | 0.309 | 0.309 | A | 454.0 | 429.0 | 13 | 29 | 16 | 13 | [[262, 513]] | 1.0 | 3vs5 | TYR_HCK_HUMAN | TYR | 1.4e-95 | 325.6 | 1.0 | 260.0 | 260.0 | 398 | 399 | 400 | 402 | 404 | 290 | 305 | 309 | 378 | 380 | 379 | 381.0 | 439 | 427 | 422 | 421 | 420 | 419 | 418 | 417 | 416 | 334 | Tyrosine-protein kinase HCK |
| TYR | HCK | HCK_HUMAN | 3VS5B | P08631 | 81 | 526 | 526.0 | VSG:60601 | Type1 | Inactive | DFGin | 5.4472 | 12.5823 | BLBplus | -103.49, 162.99 | 68.58, 22.76 | -66.54, 121.33 | 37.51, 94.92 | 89.07, -18.65 | out-out | out | 13.3899 | Saltbr-out | 15.2332 | HRD-in | -74.25, -62.25 | 87.12, -19.0 | out-out-none | SNCoon | out-none | ActLoopNT-out | 7.0627 | ActLoopCT-none | TYR | APEdihe_nnnai | APEdist_aaan | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 999.0 | APE8-dihe-none | 999.0, 0.98 | APE8-rot-na | 18.82 | APE67-dihe-in | -69.89, 0.28 | -92.91, -10.56 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-none | 999.0 | Q523E,Q524E,Q525I | PTR522 | PTR522 | XRAY | 2.851 | 0.309 | 0.309 | B | 454.0 | 427.0 | 13 | 29 | 16 | 13 | [[262, 513]] | 1.0 | 3vs5 | TYR_HCK_HUMAN | TYR | 1.4e-95 | 325.6 | 1.0 | 260.0 | 260.0 | 398 | 399 | 400 | 402 | 404 | 290 | 305 | 309 | 378 | 380 | 379 | 381.0 | 439 | 427 | 422 | 421 | 420 | 419 | 418 | 417 | 416 | 334 | Tyrosine-protein kinase HCK |
| 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 | HCK | HCK_HUMAN | 3VS5A | P08631 | 81 | 526 | 526.0 | VSG:60601 | Type1 | Inactive | DFGin | 5.3025 | 12.7869 | BLBplus | -113.17, 163.39 | 44.9, 47.31 | -70.54, 124.98 | 29.01, 97.87 | 91.21, -36.02 | out-out | out | 13.8811 | Saltbr-out | 13.6733 | HRD-in | -80.1, -56.21 | 84.49, -32.57 | out-out-none | SNCoon | out-none | ActLoopNT-out | 6.9642 | ActLoopCT-none | TYR | APEdihe_nnnai | APEdist_aaan | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 999.0 | APE8-dihe-none | 999.0, 38.63 | APE8-rot-na | 346.37 | APE67-dihe-in | -64.79, -16.3 | -91.95, -10.89 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-none | 999.0 | Q523E,Q524E,Q525I | PTR522 | PTR522 | XRAY | 2.851 | 0.309 | 0.309 | A | 454.0 | 429.0 | 13 | 29 | 16 | 13 | [[262, 513]] | 1.0 | 3vs5 | Homo sapiens | TYR_HCK_HUMAN | TYR | 1.4e-95 | 325.6 | 1.0 | 260.0 | 260.0 | 398 | 399 | 400 | 402 | 404 | 290 | 305 | 309 | 378 | 380 | 379 | 381.0 | 439 | 427 | 422 | 421 | 420 | 419 | 418 | 417 | 416 | 334 | Tyrosine-protein kinase HCK |
| TYR | HCK | HCK_HUMAN | 3VS5B | P08631 | 81 | 526 | 526.0 | VSG:60601 | Type1 | Inactive | DFGin | 5.4472 | 12.5823 | BLBplus | -103.49, 162.99 | 68.58, 22.76 | -66.54, 121.33 | 37.51, 94.92 | 89.07, -18.65 | out-out | out | 13.3899 | Saltbr-out | 15.2332 | HRD-in | -74.25, -62.25 | 87.12, -19.0 | out-out-none | SNCoon | out-none | ActLoopNT-out | 7.0627 | ActLoopCT-none | TYR | APEdihe_nnnai | APEdist_aaan | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 999.0 | APE8-dihe-none | 999.0, 0.98 | APE8-rot-na | 18.82 | APE67-dihe-in | -69.89, 0.28 | -92.91, -10.56 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-none | 999.0 | Q523E,Q524E,Q525I | PTR522 | PTR522 | XRAY | 2.851 | 0.309 | 0.309 | B | 454.0 | 427.0 | 13 | 29 | 16 | 13 | [[262, 513]] | 1.0 | 3vs5 | Homo sapiens | TYR_HCK_HUMAN | TYR | 1.4e-95 | 325.6 | 1.0 | 260.0 | 260.0 | 398 | 399 | 400 | 402 | 404 | 290 | 305 | 309 | 378 | 380 | 379 | 381.0 | 439 | 427 | 422 | 421 | 420 | 419 | 418 | 417 | 416 | 334 | Tyrosine-protein kinase HCK |
| 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 |
|---|