6WA2
Crystal structure of EGFR(T790M/V948R) in complex with LN3753
Summary for 6WA2
Entry DOI | 10.2210/pdb6wa2/pdb |
Descriptor | Epidermal growth factor receptor, N-(3-{5-[2-(acetylamino)pyridin-4-yl]-2-(methylsulfanyl)-1H-imidazol-4-yl}phenyl)-2-fluoro-5-hydroxybenzamide, CHLORIDE ION, ... (4 entities in total) |
Functional Keywords | drug discovery, cancer, transferase |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 4 |
Total formula weight | 151933.87 |
Authors | Heppner, D.E.,Eck, M.J. (deposition date: 2020-03-24, release date: 2021-03-31, Last modification date: 2023-10-18) |
Primary citation | Wittlinger, F.,Heppner, D.E.,To, C.,Gunther, M.,Shin, B.H.,Rana, J.K.,Schmoker, A.M.,Beyett, T.S.,Berger, L.M.,Berger, B.T.,Bauer, N.,Vasta, J.D.,Corona, C.R.,Robers, M.B.,Knapp, S.,Janne, P.A.,Eck, M.J.,Laufer, S.A. Design of a "Two-in-One" Mutant-Selective Epidermal Growth Factor Receptor Inhibitor That Spans the Orthosteric and Allosteric Sites. J.Med.Chem., 65:1370-1383, 2022 Cited by PubMed: 34668706DOI: 10.1021/acs.jmedchem.1c00848 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.4 Å) |
Structure validation
Download full validation report