| 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 | ABL1 | ABL1_HUMAN | 4ZOGA | P00519 | 233 | 501 | 1130.0 | VX6:601 | Type1 | Inactive | DFGinter | 9.0345 | 8.1883 | None | -67.97, 132.1 | -127.82, 25.62 | -66.74, -66.47 | 163.98, 49.73 | -79.37, 45.35 | out-out | out | 10.9745 | Saltbr-out | 6.7673 | HRD-out | -91.32, 151.74 | -125.52, 16.46 | out-out-in | SNCooi | out-in | ActLoopNT-out | 5.5021 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -110.42, 138.31 | APE9-dihe-in | -118.45, 160.42 | APE8-dihe-in | -78.39, 96.94 | APE8-rot-na | 30.14 | APE67-dihe-in | -71.46, -10.56 | -52.82, -45.85 | APE12-dist-na | 19.8085 | APE11-dist-na | 15.163 | APE10-dist-na | 17.4227 | APE9-dist-in | 7.1442 | None | None | None | XRAY | 2.3 | 0.187 | 0.233 | A | 283.0 | 269.0 | 0 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 4zog | TYR_ABL1_HUMAN | TYR | 2.6e-100 | 341.0 | 1.0 | 260.0 | 260.0 | 380 | 381 | 382 | 384 | 386 | 271 | 286 | 290 | 360 | 362 | 361 | 363.0 | 421 | 409 | 404 | 403 | 402 | 401 | 400 | 399 | 398 | 316 | Tyrosine-protein kinase ABL1 |
| TYR | ABL1 | ABL1_HUMAN | 4ZOGB | P00519 | 234 | 503 | 1130.0 | VX6:601 | Type1 | Inactive | DFGout | 11.7889 | 11.8279 | None | -72.45, 126.77 | -115.82, 44.9 | -59.71, -111.34 | 30.08, 49.18 | -63.43, 48.35 | in-in | in | 8.8801 | Saltbr-in | 3.108 | HRD-in | -92.87, -52.54 | 77.42, -2.86 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.5005 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -108.26, 120.92 | APE9-dihe-in | -100.0, 141.29 | APE8-dihe-in | -74.27, 97.66 | APE8-rot-na | 25.54 | APE67-dihe-in | -72.2, -10.54 | -59.59, -40.07 | APE12-dist-na | 17.8557 | APE11-dist-na | 13.8579 | APE10-dist-na | 16.2066 | APE9-dist-in | 6.9896 | None | None | None | XRAY | 2.3 | 0.187 | 0.233 | B | 283.0 | 268.0 | 2 | 29 | 27 | 2 | [[242, 495]] | 1.0 | 4zog | TYR_ABL1_HUMAN | TYR | 2.6e-100 | 341.0 | 1.0 | 260.0 | 260.0 | 380 | 381 | 382 | 384 | 386 | 271 | 286 | 290 | 360 | 362 | 361 | 363.0 | 421 | 409 | 404 | 403 | 402 | 401 | 400 | 399 | 398 | 316 | Tyrosine-protein kinase ABL1 |
| 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 | ABL1 | ABL1_HUMAN | 4ZOGA | P00519 | 233 | 501 | 1130.0 | VX6:601 | Type1 | Inactive | DFGinter | 9.0345 | 8.1883 | None | -67.97, 132.1 | -127.82, 25.62 | -66.74, -66.47 | 163.98, 49.73 | -79.37, 45.35 | out-out | out | 10.9745 | Saltbr-out | 6.7673 | HRD-out | -91.32, 151.74 | -125.52, 16.46 | out-out-in | SNCooi | out-in | ActLoopNT-out | 5.5021 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -110.42, 138.31 | APE9-dihe-in | -118.45, 160.42 | APE8-dihe-in | -78.39, 96.94 | APE8-rot-na | 30.14 | APE67-dihe-in | -71.46, -10.56 | -52.82, -45.85 | APE12-dist-na | 19.8085 | APE11-dist-na | 15.163 | APE10-dist-na | 17.4227 | APE9-dist-in | 7.1442 | None | None | None | XRAY | 2.3 | 0.187 | 0.233 | A | 283.0 | 269.0 | 0 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 4zog | Homo sapiens | TYR_ABL1_HUMAN | TYR | 2.6e-100 | 341.0 | 1.0 | 260.0 | 260.0 | 380 | 381 | 382 | 384 | 386 | 271 | 286 | 290 | 360 | 362 | 361 | 363.0 | 421 | 409 | 404 | 403 | 402 | 401 | 400 | 399 | 398 | 316 | Tyrosine-protein kinase ABL1 |
| TYR | ABL1 | ABL1_HUMAN | 4ZOGB | P00519 | 234 | 503 | 1130.0 | VX6:601 | Type1 | Inactive | DFGout | 11.7889 | 11.8279 | None | -72.45, 126.77 | -115.82, 44.9 | -59.71, -111.34 | 30.08, 49.18 | -63.43, 48.35 | in-in | in | 8.8801 | Saltbr-in | 3.108 | HRD-in | -92.87, -52.54 | 77.42, -2.86 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.5005 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -108.26, 120.92 | APE9-dihe-in | -100.0, 141.29 | APE8-dihe-in | -74.27, 97.66 | APE8-rot-na | 25.54 | APE67-dihe-in | -72.2, -10.54 | -59.59, -40.07 | APE12-dist-na | 17.8557 | APE11-dist-na | 13.8579 | APE10-dist-na | 16.2066 | APE9-dist-in | 6.9896 | None | None | None | XRAY | 2.3 | 0.187 | 0.233 | B | 283.0 | 268.0 | 2 | 29 | 27 | 2 | [[242, 495]] | 1.0 | 4zog | Homo sapiens | TYR_ABL1_HUMAN | TYR | 2.6e-100 | 341.0 | 1.0 | 260.0 | 260.0 | 380 | 381 | 382 | 384 | 386 | 271 | 286 | 290 | 360 | 362 | 361 | 363.0 | 421 | 409 | 404 | 403 | 402 | 401 | 400 | 399 | 398 | 316 | Tyrosine-protein kinase ABL1 |
| 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 |
|---|