| 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 | 6W7OA | Q06187 | 396 | 656 | 659.0 | TL7:60701 | Type1.5_Back | Inactive | DFGin | 5.9641 | 13.0637 | BLBplus | -130.77, 168.26 | 53.04, 30.28 | -64.21, 121.6 | 37.17, 91.44 | 71.98, 4.56 | out-out | out | 14.4625 | Saltbr-out | 15.2427 | HRD-in | -75.45, -50.93 | 78.96, -16.73 | out-out-out | SNCooo | out-out | ActLoopNT-out | 8.1876 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -125.26, 14.94 | APE9-dihe-in | -73.36, 139.85 | APE8-dihe-in | -76.55, 60.58 | APE8-rot-na | 30.86 | APE67-dihe-in | -64.34, -12.26 | -50.1, -48.74 | APE12-dist-na | 17.1583 | APE11-dist-na | 18.3158 | APE10-dist-na | 13.6743 | APE9-dist-out | 8.8077 | None | None | None | XRAY | 2.17 | 0.198 | 0.24 | A | 277.0 | 261.0 | 0 | 29 | 29 | 0 | [[402, 653]] | 1.0 | 6w7o | TYR_BTK_HUMAN | TYR | 6.6e-93 | 316.7 | 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 | 6W7OB | Q06187 | 396 | 658 | 659.0 | TL7:60701 | Type1.5_Back | Inactive | DFGin | 5.6958 | 13.0469 | BLBplus | -127.43, 170.84 | 53.49, 29.22 | -63.0, 121.63 | 37.69, 90.95 | 76.44, -4.99 | out-out | out | 14.4002 | Saltbr-out | 16.3289 | HRD-in | -75.03, -53.49 | 79.63, -12.46 | out-out-out | SNCooo | out-out | ActLoopNT-out | 8.3144 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -125.25, 8.08 | APE9-dihe-in | -68.1, 141.15 | APE8-dihe-in | -74.31, 63.69 | APE8-rot-na | 30.16 | APE67-dihe-in | -66.96, -10.21 | -55.5, -47.35 | APE12-dist-na | 17.2797 | APE11-dist-na | 18.9134 | APE10-dist-na | 14.0197 | APE9-dist-out | 8.9144 | None | None | None | XRAY | 2.17 | 0.198 | 0.24 | B | 277.0 | 263.0 | 0 | 29 | 29 | 0 | [[402, 653]] | 1.0 | 6w7o | TYR_BTK_HUMAN | TYR | 6.6e-93 | 316.7 | 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 | 6W7OA | Q06187 | 396 | 656 | 659.0 | TL7:60701 | Type1.5_Back | Inactive | DFGin | 5.9641 | 13.0637 | BLBplus | -130.77, 168.26 | 53.04, 30.28 | -64.21, 121.6 | 37.17, 91.44 | 71.98, 4.56 | out-out | out | 14.4625 | Saltbr-out | 15.2427 | HRD-in | -75.45, -50.93 | 78.96, -16.73 | out-out-out | SNCooo | out-out | ActLoopNT-out | 8.1876 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -125.26, 14.94 | APE9-dihe-in | -73.36, 139.85 | APE8-dihe-in | -76.55, 60.58 | APE8-rot-na | 30.86 | APE67-dihe-in | -64.34, -12.26 | -50.1, -48.74 | APE12-dist-na | 17.1583 | APE11-dist-na | 18.3158 | APE10-dist-na | 13.6743 | APE9-dist-out | 8.8077 | None | None | None | XRAY | 2.17 | 0.198 | 0.24 | A | 277.0 | 261.0 | 0 | 29 | 29 | 0 | [[402, 653]] | 1.0 | 6w7o | Homo sapiens | TYR_BTK_HUMAN | TYR | 6.6e-93 | 316.7 | 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 | 6W7OB | Q06187 | 396 | 658 | 659.0 | TL7:60701 | Type1.5_Back | Inactive | DFGin | 5.6958 | 13.0469 | BLBplus | -127.43, 170.84 | 53.49, 29.22 | -63.0, 121.63 | 37.69, 90.95 | 76.44, -4.99 | out-out | out | 14.4002 | Saltbr-out | 16.3289 | HRD-in | -75.03, -53.49 | 79.63, -12.46 | out-out-out | SNCooo | out-out | ActLoopNT-out | 8.3144 | ActLoopCT-out | TYR | APEdihe_oiiai | APEdist_aaao | APE10-dihe-out | -125.25, 8.08 | APE9-dihe-in | -68.1, 141.15 | APE8-dihe-in | -74.31, 63.69 | APE8-rot-na | 30.16 | APE67-dihe-in | -66.96, -10.21 | -55.5, -47.35 | APE12-dist-na | 17.2797 | APE11-dist-na | 18.9134 | APE10-dist-na | 14.0197 | APE9-dist-out | 8.9144 | None | None | None | XRAY | 2.17 | 0.198 | 0.24 | B | 277.0 | 263.0 | 0 | 29 | 29 | 0 | [[402, 653]] | 1.0 | 6w7o | Homo sapiens | TYR_BTK_HUMAN | TYR | 6.6e-93 | 316.7 | 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 |
|---|