| 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 | 4WA9B | P00519 | 246 | 508 | 1130.0 | AXI:69000 | Type1 | Inactive | DFGout | 13.3112 | 10.2815 | None | -75.93, 149.51 | -77.88, -15.66 | -59.19, 118.14 | 191.81, 69.86 | 106.96, -1.52 | in-in | in | 7.643 | Saltbr-in | 2.0564 | HRD-out | -116.7, 121.02 | -81.78, -7.12 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.3274 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -127.35, 121.29 | APE9-dihe-in | -115.41, 155.9 | APE8-dihe-in | -66.84, 110.63 | APE8-rot-na | 32.52 | APE67-dihe-in | -70.78, -12.55 | -43.03, -46.3 | APE12-dist-na | 18.4998 | APE11-dist-na | 13.938 | APE10-dist-na | 17.4982 | APE9-dist-in | 6.7106 | None | None | None | XRAY | 2.2 | 0.175 | 0.212 | B | 286.0 | 263.0 | 0 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 4wa9 | TYR_ABL1_HUMAN | TYR | 2.7e-100 | 340.9 | 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 | 4WA9A | P00519 | 246 | 504 | 1130.0 | AXI:69000 | Type1 | Inactive | None | 999.0 | 10.3553 | None | -73.83, 149.34 | -77.87, -21.14 | -66.14, 121.84 | 190.75, 64.67 | 115.23, -11.12 | none-none | none | 999.0 | Saltbr-none | 999.0 | HRD-out | -124.23, 124.72 | -84.31, -3.72 | none-out-in | SNCnoi | out-in | ActLoopNT-out | 5.4093 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -107.89, 135.91 | APE9-dihe-in | -108.88, 156.35 | APE8-dihe-in | -71.91, 93.83 | APE8-rot-na | 24.22 | APE67-dihe-in | -74.38, -8.52 | -49.97, -43.55 | APE12-dist-na | 18.5615 | APE11-dist-na | 13.7767 | APE10-dist-na | 16.6613 | APE9-dist-in | 6.4914 | None | None | None | XRAY | 2.2 | 0.175 | 0.212 | A | 286.0 | 236.0 | 23 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 4wa9 | TYR_ABL1_HUMAN | TYR | 2.7e-100 | 340.9 | 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 | 4WA9B | P00519 | 246 | 508 | 1130.0 | AXI:69000 | Type1 | Inactive | DFGout | 13.3112 | 10.2815 | None | -75.93, 149.51 | -77.88, -15.66 | -59.19, 118.14 | 191.81, 69.86 | 106.96, -1.52 | in-in | in | 7.643 | Saltbr-in | 2.0564 | HRD-out | -116.7, 121.02 | -81.78, -7.12 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.3274 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -127.35, 121.29 | APE9-dihe-in | -115.41, 155.9 | APE8-dihe-in | -66.84, 110.63 | APE8-rot-na | 32.52 | APE67-dihe-in | -70.78, -12.55 | -43.03, -46.3 | APE12-dist-na | 18.4998 | APE11-dist-na | 13.938 | APE10-dist-na | 17.4982 | APE9-dist-in | 6.7106 | None | None | None | XRAY | 2.2 | 0.175 | 0.212 | B | 286.0 | 263.0 | 0 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 4wa9 | Homo sapiens | TYR_ABL1_HUMAN | TYR | 2.7e-100 | 340.9 | 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 | 4WA9A | P00519 | 246 | 504 | 1130.0 | AXI:69000 | Type1 | Inactive | None | 999.0 | 10.3553 | None | -73.83, 149.34 | -77.87, -21.14 | -66.14, 121.84 | 190.75, 64.67 | 115.23, -11.12 | none-none | none | 999.0 | Saltbr-none | 999.0 | HRD-out | -124.23, 124.72 | -84.31, -3.72 | none-out-in | SNCnoi | out-in | ActLoopNT-out | 5.4093 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -107.89, 135.91 | APE9-dihe-in | -108.88, 156.35 | APE8-dihe-in | -71.91, 93.83 | APE8-rot-na | 24.22 | APE67-dihe-in | -74.38, -8.52 | -49.97, -43.55 | APE12-dist-na | 18.5615 | APE11-dist-na | 13.7767 | APE10-dist-na | 16.6613 | APE9-dist-in | 6.4914 | None | None | None | XRAY | 2.2 | 0.175 | 0.212 | A | 286.0 | 236.0 | 23 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 4wa9 | Homo sapiens | TYR_ABL1_HUMAN | TYR | 2.7e-100 | 340.9 | 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 |
|---|