| 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 | BTK | BTK_HUMAN | AF-Q06187-K1A | Q06187 | 394 | 659 | 659.0 | No_ligand | No_ligand | Active | DFGin | 6.6004 | 13.573 | BLAminus | -136.86, -178.35 | 58.88, 65.72 | -79.63, 17.44 | 303.15, 95.81 | -59.47, -35.89 | in-in | in | 8.3739 | Saltbr-in | 2.6582 | HRD-in | -82.15, -43.22 | 66.84, -17.66 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8953 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -81.5, 145.43 | APE9-dihe-in | -141.06, 156.51 | APE8-dihe-in | -76.86, 86.05 | APE8-rot-na | 33.19 | APE67-dihe-in | -71.15, -13.64 | -39.83, -42.64 | APE12-dist-na | 14.9168 | APE11-dist-na | 10.113 | APE10-dist-na | 11.7731 | APE9-dist-in | 6.7406 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 266.0 | 266.0 | 0 | 29 | 29 | 0 | [[402, 653]] | 1.0 | AF-Q06187-K1 | TYR_BTK_HUMAN | TYR | 5.6e-93 | 316.9 | 1.0 | 258.0 | 258.0 | 538 | 539 | 540 | 542 | 544 | 430 | 445 | 449 | 518 | 520 | 519 | 521.0 | 579 | 567 | 562 | 561 | 560 | 559 | 558 | 557 | 556 | 475 | Tyrosine-protein kinase BTK |
| TYR | BTK | BTK_HUMAN | AF-Q06187-K3A | Q06187 | 394 | 659 | 659.0 | No_ligand | No_ligand | Active | DFGin | 6.1019 | 13.8994 | BLAminus | -145.41, -175.94 | 66.17, 62.18 | -83.37, 7.8 | 301.85, 98.96 | -63.25, -28.92 | in-in | in | 8.3689 | Saltbr-in | 2.681 | HRD-in | -81.43, -44.92 | 68.23, -10.51 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8809 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -76.17, 138.32 | APE9-dihe-in | -148.99, 160.92 | APE8-dihe-in | -83.4, 78.18 | APE8-rot-na | 37.74 | APE67-dihe-in | -68.88, -18.16 | -34.0, -49.11 | APE12-dist-na | 14.4676 | APE11-dist-na | 9.7184 | APE10-dist-na | 9.98 | APE9-dist-in | 5.5801 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 266.0 | 266.0 | 0 | 29 | 29 | 0 | [[402, 653]] | 1.0 | AF-Q06187-K3 | TYR_BTK_HUMAN | TYR | 5.6e-93 | 316.9 | 1.0 | 258.0 | 258.0 | 538 | 539 | 540 | 542 | 544 | 430 | 445 | 449 | 518 | 520 | 519 | 521.0 | 579 | 567 | 562 | 561 | 560 | 559 | 558 | 557 | 556 | 475 | Tyrosine-protein kinase BTK |
| 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 | BTK | BTK_HUMAN | AF-Q06187-K1A | Q06187 | 394 | 659 | 659.0 | No_ligand | No_ligand | Active | DFGin | 6.6004 | 13.573 | BLAminus | -136.86, -178.35 | 58.88, 65.72 | -79.63, 17.44 | 303.15, 95.81 | -59.47, -35.89 | in-in | in | 8.3739 | Saltbr-in | 2.6582 | HRD-in | -82.15, -43.22 | 66.84, -17.66 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8953 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -81.5, 145.43 | APE9-dihe-in | -141.06, 156.51 | APE8-dihe-in | -76.86, 86.05 | APE8-rot-na | 33.19 | APE67-dihe-in | -71.15, -13.64 | -39.83, -42.64 | APE12-dist-na | 14.9168 | APE11-dist-na | 10.113 | APE10-dist-na | 11.7731 | APE9-dist-in | 6.7406 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 266.0 | 266.0 | 0 | 29 | 29 | 0 | [[402, 653]] | 1.0 | AF-Q06187-K1 | Homo sapiens | TYR_BTK_HUMAN | TYR | 5.6e-93 | 316.9 | 1.0 | 258.0 | 258.0 | 538 | 539 | 540 | 542 | 544 | 430 | 445 | 449 | 518 | 520 | 519 | 521.0 | 579 | 567 | 562 | 561 | 560 | 559 | 558 | 557 | 556 | 475 | Tyrosine-protein kinase BTK |
| TYR | BTK | BTK_HUMAN | AF-Q06187-K3A | Q06187 | 394 | 659 | 659.0 | No_ligand | No_ligand | Active | DFGin | 6.1019 | 13.8994 | BLAminus | -145.41, -175.94 | 66.17, 62.18 | -83.37, 7.8 | 301.85, 98.96 | -63.25, -28.92 | in-in | in | 8.3689 | Saltbr-in | 2.681 | HRD-in | -81.43, -44.92 | 68.23, -10.51 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8809 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -76.17, 138.32 | APE9-dihe-in | -148.99, 160.92 | APE8-dihe-in | -83.4, 78.18 | APE8-rot-na | 37.74 | APE67-dihe-in | -68.88, -18.16 | -34.0, -49.11 | APE12-dist-na | 14.4676 | APE11-dist-na | 9.7184 | APE10-dist-na | 9.98 | APE9-dist-in | 5.5801 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 266.0 | 266.0 | 0 | 29 | 29 | 0 | [[402, 653]] | 1.0 | AF-Q06187-K3 | Homo sapiens | TYR_BTK_HUMAN | TYR | 5.6e-93 | 316.9 | 1.0 | 258.0 | 258.0 | 538 | 539 | 540 | 542 | 544 | 430 | 445 | 449 | 518 | 520 | 519 | 521.0 | 579 | 567 | 562 | 561 | 560 | 559 | 558 | 557 | 556 | 475 | Tyrosine-protein kinase BTK |
| 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 |
|---|