| 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 | 2G2HA | P00519 | 233 | 504 | 1130.0 | P16:60532 | Type1 | Inactive | DFGinter | 10.338 | 7.7628 | None | -69.8, 139.79 | -117.08, 21.66 | -74.78, -30.76 | 182.98, 70.09 | -83.63, 27.99 | in-out | in | 8.9475 | Saltbr-out | 8.4749 | HRD-out | -106.09, 125.25 | -68.95, -15.96 | out-out-in | SNCooi | out-in | ActLoopNT-out | 5.6222 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -111.55, 116.51 | APE9-dihe-in | -118.82, 162.2 | APE8-dihe-in | -67.24, 92.86 | APE8-rot-na | 32.82 | APE67-dihe-in | -70.58, -6.79 | -39.4, -50.98 | APE12-dist-na | 19.9464 | APE11-dist-na | 15.2345 | APE10-dist-na | 17.2038 | APE9-dist-in | 6.5344 | H396P | None | None | XRAY | 2.0 | 0.194 | 0.213 | A | 287.0 | 272.0 | 0 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 2g2h | TYR_ABL1_HUMAN | TYR | 6.9e-100 | 339.6 | 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 | 2G2HB | P00519 | 233 | 504 | 1130.0 | P16:60532 | Type1.5_Back | Inactive | DFGout | 12.6989 | 10.5001 | None | -60.13, 139.26 | -82.96, -16.55 | -75.2, 165.15 | 55.98, 67.58 | 79.14, 12.62 | in-out | in | 8.1928 | Saltbr-out | 6.8591 | HRD-out | -104.81, 126.85 | -89.37, -5.07 | out-out-in | SNCooi | out-in | ActLoopNT-out | 5.4813 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -117.1, 135.12 | APE9-dihe-in | -121.36, 158.85 | APE8-dihe-in | -60.74, 105.18 | APE8-rot-na | 332.86 | APE67-dihe-in | -67.82, -12.38 | -45.03, -49.81 | APE12-dist-na | 18.6686 | APE11-dist-na | 13.9016 | APE10-dist-na | 17.2439 | APE9-dist-in | 6.55 | H396P | None | None | XRAY | 2.0 | 0.194 | 0.213 | B | 287.0 | 272.0 | 0 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 2g2h | TYR_ABL1_HUMAN | TYR | 6.9e-100 | 339.6 | 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 | 2G2HA | P00519 | 233 | 504 | 1130.0 | P16:60532 | Type1 | Inactive | DFGinter | 10.338 | 7.7628 | None | -69.8, 139.79 | -117.08, 21.66 | -74.78, -30.76 | 182.98, 70.09 | -83.63, 27.99 | in-out | in | 8.9475 | Saltbr-out | 8.4749 | HRD-out | -106.09, 125.25 | -68.95, -15.96 | out-out-in | SNCooi | out-in | ActLoopNT-out | 5.6222 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -111.55, 116.51 | APE9-dihe-in | -118.82, 162.2 | APE8-dihe-in | -67.24, 92.86 | APE8-rot-na | 32.82 | APE67-dihe-in | -70.58, -6.79 | -39.4, -50.98 | APE12-dist-na | 19.9464 | APE11-dist-na | 15.2345 | APE10-dist-na | 17.2038 | APE9-dist-in | 6.5344 | H396P | None | None | XRAY | 2.0 | 0.194 | 0.213 | A | 287.0 | 272.0 | 0 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 2g2h | Homo sapiens | TYR_ABL1_HUMAN | TYR | 6.9e-100 | 339.6 | 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 | 2G2HB | P00519 | 233 | 504 | 1130.0 | P16:60532 | Type1.5_Back | Inactive | DFGout | 12.6989 | 10.5001 | None | -60.13, 139.26 | -82.96, -16.55 | -75.2, 165.15 | 55.98, 67.58 | 79.14, 12.62 | in-out | in | 8.1928 | Saltbr-out | 6.8591 | HRD-out | -104.81, 126.85 | -89.37, -5.07 | out-out-in | SNCooi | out-in | ActLoopNT-out | 5.4813 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -117.1, 135.12 | APE9-dihe-in | -121.36, 158.85 | APE8-dihe-in | -60.74, 105.18 | APE8-rot-na | 332.86 | APE67-dihe-in | -67.82, -12.38 | -45.03, -49.81 | APE12-dist-na | 18.6686 | APE11-dist-na | 13.9016 | APE10-dist-na | 17.2439 | APE9-dist-in | 6.55 | H396P | None | None | XRAY | 2.0 | 0.194 | 0.213 | B | 287.0 | 272.0 | 0 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 2g2h | Homo sapiens | TYR_ABL1_HUMAN | TYR | 6.9e-100 | 339.6 | 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 |
|---|