7B85

Crystal Structure of EGFR-WT in Complex with TAK-788

Summary for 7B85

• Entry DOI: 10.2210/pdb7b85/pdb
• Descriptor: Epidermal growth factor receptor, propan-2-yl 2-[[4-[2-(dimethylamino)ethyl-methyl-amino]-2-methoxy-5-(propanoylamino)phenyl]amino]-4-(1-methylindol-3-yl)pyrimidine-5-carboxylate, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ... (4 entities in total)
• Functional Keywords: egfr, wt, exon20, covalent, transferase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 1
• Total formula weight: 38658.70

Authors

Niggenaber, J.,Mueller, M.P.,Rauh, D. (deposition date: 2020-12-12, release date: 2022-02-23, Last modification date: 2024-01-31)

• Primary citation: Lategahn, J.,Tumbrink, H.L.,Schultz-Fademrecht, C.,Heimsoeth, A.,Werr, L.,Niggenaber, J.,Keul, M.,Parmaksiz, F.,Baumann, M.,Menninger, S.,Zent, E.,Landel, I.,Weisner, J.,Jeyakumar, K.,Heyden, L.,Russ, N.,Muller, F.,Lorenz, C.,Bragelmann, J.,Spille, I.,Grabe, T.,Muller, M.P.,Heuckmann, J.M.,Klebl, B.M.,Nussbaumer, P.,Sos, M.L.,Rauh, D.; Insight into Targeting Exon20 Insertion Mutations of the Epidermal Growth Factor Receptor with Wild Type-Sparing Inhibitors.; J.Med.Chem., 65:6643-6655, 2022; PubMed: 35486541; DOI: 10.1021/acs.jmedchem.1c02080

Experimental method

X-RAY DIFFRACTION (2.5 Å)