| 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 | EGFR | EGFR_HUMAN | 3IKAA | P00533 | 696 | 1020 | 1210.0 | 0UN:1797 | Type1 | Inactive | DFGin | 5.7776 | 14.3544 | ABAminus | -126.08, -29.6 | -103.63, 124.88 | -119.83, 2.06 | 294.25, 104.41 | -43.93, -35.44 | in-in | in | 9.4422 | Saltbr-in | 3.2201 | HRD-in | -72.42, -49.2 | 76.65, -5.52 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9099 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -121.67, 130.5 | APE9-dihe-in | -133.91, 150.07 | APE8-dihe-in | -89.48, 105.4 | APE8-rot-na | 32.64 | APE67-dihe-in | -62.96, -1.82 | -70.92, -51.09 | APE12-dist-na | 11.0816 | APE11-dist-na | 9.1284 | APE10-dist-na | 9.9399 | APE9-dist-in | 6.7425 | T790M | None | None | XRAY | 2.9 | 0.21 | 0.257 | A | 331.0 | 310.0 | 0 | 30 | 30 | 0 | [[712, 970]] | 1.0 | 3ika | TYR_EGFR_HUMAN | TYR | 8.4e-88 | 300.1 | 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 | 5X2KA | P00533 | 696 | 1020 | 1210.0 | 0UN:1101 | Type1 | Active | DFGin | 6.2518 | 15.4016 | BLAminus | -162.18, -166.94 | 57.57, 64.19 | -89.05, 1.52 | 298.25, 111.15 | -60.1, -40.29 | in-in | in | 8.3767 | Saltbr-in | 3.2309 | HRD-in | -63.42, -47.14 | 78.88, -6.86 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7308 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -101.48, 127.33 | APE9-dihe-in | -122.09, 137.71 | APE8-dihe-in | -92.31, 106.07 | APE8-rot-na | 35.16 | APE67-dihe-in | -60.76, -39.83 | -65.9, -37.9 | APE12-dist-na | 13.7192 | APE11-dist-na | 11.8401 | APE10-dist-na | 11.7833 | APE9-dist-in | 7.9573 | T790M | None | None | XRAY | 3.201 | 0.227 | 0.244 | A | 327.0 | 314.0 | 8 | 30 | 24 | 6 | [[712, 970]] | 1.0 | 5x2k | TYR_EGFR_HUMAN | TYR | 8e-88 | 300.2 | 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 | 7ZYNA | P00533 | 697 | 1018 | 1210.0 | 0UN:1101 | Type1 | Active | DFGin | 5.8962 | 15.0459 | BLAminus | -145.65, -166.89 | 58.05, 78.44 | -95.11, 31.85 | 294.9, 83.85 | -65.75, -30.64 | in-in | in | 8.4425 | Saltbr-in | 2.894 | HRD-in | -73.97, -47.38 | 70.32, 2.73 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8987 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -66.42, 134.47 | APE9-dihe-in | -142.75, 146.34 | APE8-dihe-in | -74.74, 108.36 | APE8-rot-na | 25.93 | APE67-dihe-in | -69.45, -12.52 | -69.08, -37.0 | APE12-dist-na | 12.4223 | APE11-dist-na | 9.1781 | APE10-dist-na | 10.4792 | APE9-dist-in | 6.5537 | T790M,C797S,E865A,E866A,K867A | None | None | XRAY | 2.3 | 0.193 | 0.223 | A | 333.0 | 317.0 | 4 | 30 | 30 | 0 | [[712, 970]] | 1.0 | 7zyn | TYR_EGFR_HUMAN | TYR | 3.4e-87 | 298.1 | 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 | EGFR | EGFR_HUMAN | 3IKAA | P00533 | 696 | 1020 | 1210.0 | 0UN:1797 | Type1 | Inactive | DFGin | 5.7776 | 14.3544 | ABAminus | -126.08, -29.6 | -103.63, 124.88 | -119.83, 2.06 | 294.25, 104.41 | -43.93, -35.44 | in-in | in | 9.4422 | Saltbr-in | 3.2201 | HRD-in | -72.42, -49.2 | 76.65, -5.52 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9099 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -121.67, 130.5 | APE9-dihe-in | -133.91, 150.07 | APE8-dihe-in | -89.48, 105.4 | APE8-rot-na | 32.64 | APE67-dihe-in | -62.96, -1.82 | -70.92, -51.09 | APE12-dist-na | 11.0816 | APE11-dist-na | 9.1284 | APE10-dist-na | 9.9399 | APE9-dist-in | 6.7425 | T790M | None | None | XRAY | 2.9 | 0.21 | 0.257 | A | 331.0 | 310.0 | 0 | 30 | 30 | 0 | [[712, 970]] | 1.0 | 3ika | Homo sapiens | TYR_EGFR_HUMAN | TYR | 8.4e-88 | 300.1 | 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 | 5X2KA | P00533 | 696 | 1020 | 1210.0 | 0UN:1101 | Type1 | Active | DFGin | 6.2518 | 15.4016 | BLAminus | -162.18, -166.94 | 57.57, 64.19 | -89.05, 1.52 | 298.25, 111.15 | -60.1, -40.29 | in-in | in | 8.3767 | Saltbr-in | 3.2309 | HRD-in | -63.42, -47.14 | 78.88, -6.86 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7308 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -101.48, 127.33 | APE9-dihe-in | -122.09, 137.71 | APE8-dihe-in | -92.31, 106.07 | APE8-rot-na | 35.16 | APE67-dihe-in | -60.76, -39.83 | -65.9, -37.9 | APE12-dist-na | 13.7192 | APE11-dist-na | 11.8401 | APE10-dist-na | 11.7833 | APE9-dist-in | 7.9573 | T790M | None | None | XRAY | 3.201 | 0.227 | 0.244 | A | 327.0 | 314.0 | 8 | 30 | 24 | 6 | [[712, 970]] | 1.0 | 5x2k | Homo sapiens | TYR_EGFR_HUMAN | TYR | 8e-88 | 300.2 | 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 | 7ZYNA | P00533 | 697 | 1018 | 1210.0 | 0UN:1101 | Type1 | Active | DFGin | 5.8962 | 15.0459 | BLAminus | -145.65, -166.89 | 58.05, 78.44 | -95.11, 31.85 | 294.9, 83.85 | -65.75, -30.64 | in-in | in | 8.4425 | Saltbr-in | 2.894 | HRD-in | -73.97, -47.38 | 70.32, 2.73 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8987 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -66.42, 134.47 | APE9-dihe-in | -142.75, 146.34 | APE8-dihe-in | -74.74, 108.36 | APE8-rot-na | 25.93 | APE67-dihe-in | -69.45, -12.52 | -69.08, -37.0 | APE12-dist-na | 12.4223 | APE11-dist-na | 9.1781 | APE10-dist-na | 10.4792 | APE9-dist-in | 6.5537 | T790M,C797S,E865A,E866A,K867A | None | None | XRAY | 2.3 | 0.193 | 0.223 | A | 333.0 | 317.0 | 4 | 30 | 30 | 0 | [[712, 970]] | 1.0 | 7zyn | Homo sapiens | TYR_EGFR_HUMAN | TYR | 3.4e-87 | 298.1 | 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 |
|---|