| 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 | 3DK7A | P00520 | 233 | 502 | 1123.0 | SX7:1 | Type1 | Inactive | DFGinter | 9.5206 | 4.4696 | None | -65.94, 133.62 | -136.37, 26.36 | -59.29, -46.94 | 277.65, 138.09 | -96.98, 21.57 | in-in | in | 7.7662 | Saltbr-in | 2.7931 | HRD-in | -90.33, -58.06 | 79.79, -1.99 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.6754 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -107.5, 130.75 | APE9-dihe-in | -114.11, 153.09 | APE8-dihe-in | -69.74, 90.62 | APE8-rot-na | 25.02 | APE67-dihe-in | -72.01, -11.59 | -51.31, -42.54 | APE12-dist-na | 20.5794 | APE11-dist-na | 15.9289 | APE10-dist-na | 18.2248 | APE9-dist-in | 7.4473 | T315I,L445P | PTR393 | PTR393 | XRAY | 2.01 | 0.216 | 0.242 | A | 277.0 | 266.0 | 4 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 3dk7 | Mus musculus | TYR_ABL1_MOUSE | 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_MOUSE | 3DK7B | P00520 | 233 | 505 | 1123.0 | SX7:2 | Type1 | Inactive | None | 999.0 | 999.0 | None | -70.09, 131.91 | -99.1, 30.92 | -47.67, -78.64 | 999.0, 999.0 | -116.53, 59.69 | in-none | in | 8.1534 | Saltbr-none | 999.0 | HRD-in | -96.35, -57.33 | 75.78, -1.22 | none-out-in | SNCnoi | out-in | ActLoopNT-out | 5.6353 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -102.0, 138.44 | APE9-dihe-in | -123.96, 150.21 | APE8-dihe-in | -64.33, 99.33 | APE8-rot-na | 21.28 | APE67-dihe-in | -72.95, -10.57 | -50.9, -44.43 | APE12-dist-na | 19.1355 | APE11-dist-na | 14.4826 | APE10-dist-na | 17.474 | APE9-dist-in | 7.0192 | T315I,L445P | PTR393 | PTR393 | XRAY | 2.01 | 0.216 | 0.242 | B | 277.0 | 269.0 | 4 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 3dk7 | Mus musculus | TYR_ABL1_MOUSE | 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_MOUSE | 3DK7A | P00520 | 233 | 502 | 1123.0 | SX7:1 | Type1 | Inactive | DFGinter | 9.5206 | 4.4696 | None | -65.94, 133.62 | -136.37, 26.36 | -59.29, -46.94 | 277.65, 138.09 | -96.98, 21.57 | in-in | in | 7.7662 | Saltbr-in | 2.7931 | HRD-in | -90.33, -58.06 | 79.79, -1.99 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.6754 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -107.5, 130.75 | APE9-dihe-in | -114.11, 153.09 | APE8-dihe-in | -69.74, 90.62 | APE8-rot-na | 25.02 | APE67-dihe-in | -72.01, -11.59 | -51.31, -42.54 | APE12-dist-na | 20.5794 | APE11-dist-na | 15.9289 | APE10-dist-na | 18.2248 | APE9-dist-in | 7.4473 | T315I,L445P | PTR393 | PTR393 | XRAY | 2.01 | 0.216 | 0.242 | A | 277.0 | 266.0 | 4 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 3dk7 | Mus musculus | TYR_ABL1_MOUSE | 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_MOUSE | 3DK7B | P00520 | 233 | 505 | 1123.0 | SX7:2 | Type1 | Inactive | None | 999.0 | 999.0 | None | -70.09, 131.91 | -99.1, 30.92 | -47.67, -78.64 | 999.0, 999.0 | -116.53, 59.69 | in-none | in | 8.1534 | Saltbr-none | 999.0 | HRD-in | -96.35, -57.33 | 75.78, -1.22 | none-out-in | SNCnoi | out-in | ActLoopNT-out | 5.6353 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -102.0, 138.44 | APE9-dihe-in | -123.96, 150.21 | APE8-dihe-in | -64.33, 99.33 | APE8-rot-na | 21.28 | APE67-dihe-in | -72.95, -10.57 | -50.9, -44.43 | APE12-dist-na | 19.1355 | APE11-dist-na | 14.4826 | APE10-dist-na | 17.474 | APE9-dist-in | 7.0192 | T315I,L445P | PTR393 | PTR393 | XRAY | 2.01 | 0.216 | 0.242 | B | 277.0 | 269.0 | 4 | 29 | 29 | 0 | [[242, 495]] | 1.0 | 3dk7 | Mus musculus | TYR_ABL1_MOUSE | 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 |