| 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 | 8I7ZB | P00519 | 232 | 500 | 1130.0 | 6CI:601 | Type1 | Inactive | DFGinter | 8.4667 | 7.1288 | None | -66.85, 127.11 | -111.9, 44.88 | -97.85, -10.98 | 300.72, 89.67 | -118.62, 22.53 | in-in | in | 8.811 | Saltbr-in | 3.0792 | HRD-in | -103.27, -34.43 | 69.06, -16.77 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.476 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -96.59, 128.54 | APE9-dihe-in | -113.43, 144.92 | APE8-dihe-in | -66.08, 92.18 | APE8-rot-na | 22.51 | APE67-dihe-in | -69.32, -14.4 | -51.28, -44.78 | APE12-dist-na | 18.5835 | APE11-dist-na | 13.9516 | APE10-dist-na | 16.6887 | APE9-dist-in | 6.9075 | None | PTR393 | PTR393 | XRAY | 2.255 | 0.177 | 0.213 | B | 272.0 | 265.0 | 4 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 8i7z | TYR_ABL1_HUMAN | TYR | 2.2e-100 | 341.2 | 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 | 8I7ZA | P00519 | 232 | 499 | 1130.0 | 6CI:601,BAL:602 | Type1,Type1 | Inactive | DFGinter | 8.675 | 7.469 | None | -68.15, 124.34 | -115.26, 44.89 | -92.28, -20.89 | 299.64, 92.88 | -113.55, 33.09 | in-none | in | 9.0131 | Saltbr-none | 999.0 | HRD-in | -101.45, -51.38 | 75.46, -1.93 | none-out-in | SNCnoi | out-in | ActLoopNT-out | 5.7346 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -105.91, 129.83 | APE9-dihe-in | -107.25, 158.29 | APE8-dihe-in | -77.21, 88.15 | APE8-rot-na | 26.6 | APE67-dihe-in | -78.48, -3.49 | -49.13, -44.82 | APE12-dist-na | 19.9913 | APE11-dist-na | 15.3458 | APE10-dist-na | 18.0738 | APE9-dist-in | 7.5127 | None | PTR393 | PTR393 | XRAY | 2.255 | 0.177 | 0.213 | A | 272.0 | 258.0 | 10 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 8i7z | TYR_ABL1_HUMAN | TYR | 2.2e-100 | 341.2 | 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 | 8I7ZB | P00519 | 232 | 500 | 1130.0 | 6CI:601 | Type1 | Inactive | DFGinter | 8.4667 | 7.1288 | None | -66.85, 127.11 | -111.9, 44.88 | -97.85, -10.98 | 300.72, 89.67 | -118.62, 22.53 | in-in | in | 8.811 | Saltbr-in | 3.0792 | HRD-in | -103.27, -34.43 | 69.06, -16.77 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.476 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -96.59, 128.54 | APE9-dihe-in | -113.43, 144.92 | APE8-dihe-in | -66.08, 92.18 | APE8-rot-na | 22.51 | APE67-dihe-in | -69.32, -14.4 | -51.28, -44.78 | APE12-dist-na | 18.5835 | APE11-dist-na | 13.9516 | APE10-dist-na | 16.6887 | APE9-dist-in | 6.9075 | None | PTR393 | PTR393 | XRAY | 2.255 | 0.177 | 0.213 | B | 272.0 | 265.0 | 4 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 8i7z | Homo sapiens | TYR_ABL1_HUMAN | TYR | 2.2e-100 | 341.2 | 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 | 8I7ZA | P00519 | 232 | 499 | 1130.0 | 6CI:601,BAL:602 | Type1,Type1 | Inactive | DFGinter | 8.675 | 7.469 | None | -68.15, 124.34 | -115.26, 44.89 | -92.28, -20.89 | 299.64, 92.88 | -113.55, 33.09 | in-none | in | 9.0131 | Saltbr-none | 999.0 | HRD-in | -101.45, -51.38 | 75.46, -1.93 | none-out-in | SNCnoi | out-in | ActLoopNT-out | 5.7346 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -105.91, 129.83 | APE9-dihe-in | -107.25, 158.29 | APE8-dihe-in | -77.21, 88.15 | APE8-rot-na | 26.6 | APE67-dihe-in | -78.48, -3.49 | -49.13, -44.82 | APE12-dist-na | 19.9913 | APE11-dist-na | 15.3458 | APE10-dist-na | 18.0738 | APE9-dist-in | 7.5127 | None | PTR393 | PTR393 | XRAY | 2.255 | 0.177 | 0.213 | A | 272.0 | 258.0 | 10 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 8i7z | Homo sapiens | TYR_ABL1_HUMAN | TYR | 2.2e-100 | 341.2 | 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 |
|---|