| 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 | 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 |
|---|
| 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_MOUSE | 3K5VA | P00520 | 229 | 510 | 1123.0 | STJ:60001,STI:60002 | Allosteric,Type2 | Inactive | DFGout | 13.8272 | 11.0249 | BBAminus | -129.03, -178.81 | -148.62, 103.08 | -90.49, -4.28 | 302.25, 133.06 | 63.11, 53.01 | in-in | in | 8.2222 | Saltbr-in | 2.8352 | HRD-in | -81.75, -55.21 | 87.7, -18.23 | in-out-in | SNCioi | out-in | ActLoopNT-out | 16.3689 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -108.52, 121.82 | APE9-dihe-in | -113.18, 143.79 | APE8-dihe-in | -83.6, 88.45 | APE8-rot-na | 28.73 | APE67-dihe-in | -74.9, -7.51 | -50.51, -43.0 | APE12-dist-na | 15.7887 | APE11-dist-na | 11.6924 | APE10-dist-na | 8.4451 | APE9-dist-in | 7.7803 | None | None | None | XRAY | 1.74 | 0.201 | 0.231 | A | 293.0 | 281.0 | 1 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 3k5v | Mus musculus | TYR_ABL1_MOUSE | TYR | 2.9e-100 | 340.8 | 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_MOUSE | 3K5VB | P00520 | 229 | 510 | 1123.0 | STJ:60001,STI:60002 | Allosteric,Type2 | Inactive | DFGout | 13.7649 | 11.0764 | BBAminus | -130.59, 178.94 | -144.92, 105.3 | -91.47, 1.18 | 305.46, 130.21 | 51.7, 50.11 | in-in | in | 8.2219 | Saltbr-in | 2.8668 | HRD-in | -85.29, -53.14 | 86.12, -16.51 | in-out-in | SNCioi | out-in | ActLoopNT-out | 16.4024 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -115.28, 125.5 | APE9-dihe-in | -111.48, 141.99 | APE8-dihe-in | -82.96, 81.2 | APE8-rot-na | 29.67 | APE67-dihe-in | -69.06, -10.18 | -42.49, -48.14 | APE12-dist-na | 15.5836 | APE11-dist-na | 11.5044 | APE10-dist-na | 8.5983 | APE9-dist-in | 7.7555 | None | None | None | XRAY | 1.74 | 0.201 | 0.231 | B | 293.0 | 279.0 | 3 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 3k5v | Mus musculus | TYR_ABL1_MOUSE | TYR | 2.9e-100 | 340.8 | 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_MOUSE | 3K5VA | P00520 | 229 | 510 | 1123.0 | STJ:60001,STI:60002 | Allosteric,Type2 | Inactive | DFGout | 13.8272 | 11.0249 | BBAminus | -129.03, -178.81 | -148.62, 103.08 | -90.49, -4.28 | 302.25, 133.06 | 63.11, 53.01 | in-in | in | 8.2222 | Saltbr-in | 2.8352 | HRD-in | -81.75, -55.21 | 87.7, -18.23 | in-out-in | SNCioi | out-in | ActLoopNT-out | 16.3689 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -108.52, 121.82 | APE9-dihe-in | -113.18, 143.79 | APE8-dihe-in | -83.6, 88.45 | APE8-rot-na | 28.73 | APE67-dihe-in | -74.9, -7.51 | -50.51, -43.0 | APE12-dist-na | 15.7887 | APE11-dist-na | 11.6924 | APE10-dist-na | 8.4451 | APE9-dist-in | 7.7803 | None | None | None | XRAY | 1.74 | 0.201 | 0.231 | A | 293.0 | 281.0 | 1 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 3k5v | Mus musculus | TYR_ABL1_MOUSE | TYR | 2.9e-100 | 340.8 | 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_MOUSE | 3K5VB | P00520 | 229 | 510 | 1123.0 | STJ:60001,STI:60002 | Allosteric,Type2 | Inactive | DFGout | 13.7649 | 11.0764 | BBAminus | -130.59, 178.94 | -144.92, 105.3 | -91.47, 1.18 | 305.46, 130.21 | 51.7, 50.11 | in-in | in | 8.2219 | Saltbr-in | 2.8668 | HRD-in | -85.29, -53.14 | 86.12, -16.51 | in-out-in | SNCioi | out-in | ActLoopNT-out | 16.4024 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -115.28, 125.5 | APE9-dihe-in | -111.48, 141.99 | APE8-dihe-in | -82.96, 81.2 | APE8-rot-na | 29.67 | APE67-dihe-in | -69.06, -10.18 | -42.49, -48.14 | APE12-dist-na | 15.5836 | APE11-dist-na | 11.5044 | APE10-dist-na | 8.5983 | APE9-dist-in | 7.7555 | None | None | None | XRAY | 1.74 | 0.201 | 0.231 | B | 293.0 | 279.0 | 3 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 3k5v | Mus musculus | TYR_ABL1_MOUSE | TYR | 2.9e-100 | 340.8 | 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 |