| 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 | 3IKAB | P00533 | 697 | 1017 | 1210.0 | No_ligand | No_ligand | Inactive | DFGinter | 8.7168 | 4.6035 | None | -75.22, 143.75 | -113.63, 39.19 | -87.68, 145.68 | 264.7, 149.87 | 65.59, 19.15 | in-in | in | 7.748 | Saltbr-in | 2.7213 | HRD-in | -71.43, -56.54 | 82.98, -12.02 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.388 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -70.44, 137.59 | APE9-dihe-in | -139.25, 153.6 | APE8-dihe-in | -85.59, 76.58 | APE8-rot-na | 26.0 | APE67-dihe-in | -74.82, -10.46 | -52.9, -35.6 | APE12-dist-na | 16.9088 | APE11-dist-na | 15.8223 | APE10-dist-na | 16.7258 | APE9-dist-in | 7.7644 | T790M | None | None | XRAY | 2.9 | 0.21 | 0.257 | B | 331.0 | 310.0 | 2 | 30 | 28 | 2 | [[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 |
| 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 | 3IKAB | P00533 | 697 | 1017 | 1210.0 | No_ligand | No_ligand | Inactive | DFGinter | 8.7168 | 4.6035 | None | -75.22, 143.75 | -113.63, 39.19 | -87.68, 145.68 | 264.7, 149.87 | 65.59, 19.15 | in-in | in | 7.748 | Saltbr-in | 2.7213 | HRD-in | -71.43, -56.54 | 82.98, -12.02 | in-out-in | SNCioi | out-in | ActLoopNT-out | 5.388 | ActLoopCT-in | TYR | APEdihe_iiiai | APEdist_aaai | APE10-dihe-in | -70.44, 137.59 | APE9-dihe-in | -139.25, 153.6 | APE8-dihe-in | -85.59, 76.58 | APE8-rot-na | 26.0 | APE67-dihe-in | -74.82, -10.46 | -52.9, -35.6 | APE12-dist-na | 16.9088 | APE11-dist-na | 15.8223 | APE10-dist-na | 16.7258 | APE9-dist-in | 7.7644 | T790M | None | None | XRAY | 2.9 | 0.21 | 0.257 | B | 331.0 | 310.0 | 2 | 30 | 28 | 2 | [[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 |
| 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 |
|---|