| 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 | 5P9LA | Q06187 | 392 | 657 | 659.0 | 7G9:701 | Type1 | Inactive | DFGin | 6.0865 | 13.7982 | BLBplus | -122.11, 164.8 | 58.63, 30.82 | -60.7, 123.17 | 37.36, 89.52 | 81.48, -10.88 | out-none | out | 14.5981 | Saltbr-none | 999.0 | HRD-in | -66.82, -52.81 | 82.97, -17.59 | none-out-out | SNCnoo | out-out | ActLoopNT-out | 8.2767 | ActLoopCT-out | TYR | APEdihe_niiai | APEdist_aaao | APE10-dihe-none | 999.0, 121.97 | APE9-dihe-in | -75.24, 140.2 | APE8-dihe-in | -82.91, 65.05 | APE8-rot-na | 32.95 | APE67-dihe-in | -69.39, -8.36 | -46.7, -47.3 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 14.3777 | APE9-dist-out | 8.43 | None | None | None | XRAY | 1.25 | 0.266 | 0.28 | A | 279.0 | 252.0 | 14 | 29 | 19 | 10 | [[402, 653]] | 1.0 | 5p9l | TYR_BTK_HUMAN | TYR | 6.7e-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 | EGFR | EGFR_HUMAN | 7A2AA | P00533 | 700 | 984 | 1210.0 | 57N:1101,7G9:1102 | Type3,Type1 | Inactive | DFGin | 4.7896 | 14.9811 | BLBplus | -131.59, 170.62 | 61.54, 34.7 | -80.75, 149.06 | 48.24, 92.48 | 77.59, 7.85 | out-out | out | 13.5214 | Saltbr-out | 11.363 | HRD-in | -68.93, -60.4 | 81.46, -8.87 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 119.16 | APE8-dihe-in | -83.82, 69.63 | APE8-rot-na | 32.14 | APE67-dihe-in | -69.62, -9.49 | -57.3, -43.46 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 8.0196 | T790M,V948R | None | None | XRAY | 1.9 | 0.195 | 0.217 | A | 333.0 | 266.0 | 19 | 30 | 13 | 17 | [[712, 970]] | 1.0 | 7a2a | TYR_EGFR_HUMAN | TYR | 6.4e-88 | 300.5 | 3.0 | 259.0 | 257.0 | 854 | 855 | 856 | 858 | 860 | 745 | 762 | 766 | 834 | 836 | 835 | 837.0 | 896 | 884 | 879 | 878 | 877 | 876 | 875 | 874 | 873 | 791 | Epidermal growth factor receptor |
| TYR | EGFR | EGFR_HUMAN | 7A2AB | P00533 | 699 | 984 | 1210.0 | 57N:1101,7G9:1102 | Type3,Type1 | Inactive | DFGin | 5.4288 | 14.7542 | BLBplus | -131.31, 171.38 | 59.7, 35.33 | -84.58, 153.3 | 50.04, 92.4 | 77.68, 999.0 | out-out | out | 13.1596 | Saltbr-out | 10.4376 | HRD-in | -66.1, -59.16 | 82.47, -6.26 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 120.47 | APE8-dihe-in | -82.95, 68.33 | APE8-rot-na | 32.13 | APE67-dihe-in | -69.29, -8.38 | -57.66, -41.44 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 8.1601 | T790M,V948R | None | None | XRAY | 1.9 | 0.195 | 0.217 | B | 333.0 | 268.0 | 18 | 30 | 12 | 18 | [[712, 970]] | 1.0 | 7a2a | TYR_EGFR_HUMAN | TYR | 6.4e-88 | 300.5 | 3.0 | 259.0 | 257.0 | 854 | 855 | 856 | 858 | 860 | 745 | 762 | 766 | 834 | 836 | 835 | 837.0 | 896 | 884 | 879 | 878 | 877 | 876 | 875 | 874 | 873 | 791 | Epidermal growth factor receptor |
| 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 | 5P9LA | Q06187 | 392 | 657 | 659.0 | 7G9:701 | Type1 | Inactive | DFGin | 6.0865 | 13.7982 | BLBplus | -122.11, 164.8 | 58.63, 30.82 | -60.7, 123.17 | 37.36, 89.52 | 81.48, -10.88 | out-none | out | 14.5981 | Saltbr-none | 999.0 | HRD-in | -66.82, -52.81 | 82.97, -17.59 | none-out-out | SNCnoo | out-out | ActLoopNT-out | 8.2767 | ActLoopCT-out | TYR | APEdihe_niiai | APEdist_aaao | APE10-dihe-none | 999.0, 121.97 | APE9-dihe-in | -75.24, 140.2 | APE8-dihe-in | -82.91, 65.05 | APE8-rot-na | 32.95 | APE67-dihe-in | -69.39, -8.36 | -46.7, -47.3 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 14.3777 | APE9-dist-out | 8.43 | None | None | None | XRAY | 1.25 | 0.266 | 0.28 | A | 279.0 | 252.0 | 14 | 29 | 19 | 10 | [[402, 653]] | 1.0 | 5p9l | Homo sapiens | TYR_BTK_HUMAN | TYR | 6.7e-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 | EGFR | EGFR_HUMAN | 7A2AA | P00533 | 700 | 984 | 1210.0 | 57N:1101,7G9:1102 | Type3,Type1 | Inactive | DFGin | 4.7896 | 14.9811 | BLBplus | -131.59, 170.62 | 61.54, 34.7 | -80.75, 149.06 | 48.24, 92.48 | 77.59, 7.85 | out-out | out | 13.5214 | Saltbr-out | 11.363 | HRD-in | -68.93, -60.4 | 81.46, -8.87 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 119.16 | APE8-dihe-in | -83.82, 69.63 | APE8-rot-na | 32.14 | APE67-dihe-in | -69.62, -9.49 | -57.3, -43.46 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 8.0196 | T790M,V948R | None | None | XRAY | 1.9 | 0.195 | 0.217 | A | 333.0 | 266.0 | 19 | 30 | 13 | 17 | [[712, 970]] | 1.0 | 7a2a | Homo sapiens | TYR_EGFR_HUMAN | TYR | 6.4e-88 | 300.5 | 3.0 | 259.0 | 257.0 | 854 | 855 | 856 | 858 | 860 | 745 | 762 | 766 | 834 | 836 | 835 | 837.0 | 896 | 884 | 879 | 878 | 877 | 876 | 875 | 874 | 873 | 791 | Epidermal growth factor receptor |
| TYR | EGFR | EGFR_HUMAN | 7A2AB | P00533 | 699 | 984 | 1210.0 | 57N:1101,7G9:1102 | Type3,Type1 | Inactive | DFGin | 5.4288 | 14.7542 | BLBplus | -131.31, 171.38 | 59.7, 35.33 | -84.58, 153.3 | 50.04, 92.4 | 77.68, 999.0 | out-out | out | 13.1596 | Saltbr-out | 10.4376 | HRD-in | -66.1, -59.16 | 82.47, -6.26 | out-none-out | SNCono | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | TYR | APEdihe_nniai | APEdist_aaao | APE10-dihe-none | 999.0, 999.0 | APE9-dihe-none | 999.0, 120.47 | APE8-dihe-in | -82.95, 68.33 | APE8-rot-na | 32.13 | APE67-dihe-in | -69.29, -8.38 | -57.66, -41.44 | APE12-dist-na | 999.0 | APE11-dist-na | 999.0 | APE10-dist-na | 999.0 | APE9-dist-out | 8.1601 | T790M,V948R | None | None | XRAY | 1.9 | 0.195 | 0.217 | B | 333.0 | 268.0 | 18 | 30 | 12 | 18 | [[712, 970]] | 1.0 | 7a2a | Homo sapiens | TYR_EGFR_HUMAN | TYR | 6.4e-88 | 300.5 | 3.0 | 259.0 | 257.0 | 854 | 855 | 856 | 858 | 860 | 745 | 762 | 766 | 834 | 836 | 835 | 837.0 | 896 | 884 | 879 | 878 | 877 | 876 | 875 | 874 | 873 | 791 | Epidermal growth factor receptor |
| 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 |
|---|