6TFW

Crystal Structure of EGFR T790M/V948R in Complex with Covalent Pyrrolopyrimidine 18d

6TFW の概要

• エントリーDOI: 10.2210/pdb6tfw/pdb
• 分子名称: Epidermal growth factor receptor, ~{N}-[5-[4-[[3-chloranyl-4-(pyridin-2-ylmethoxy)phenyl]amino]-7~{H}-pyrrolo[2,3-d]pyrimidin-5-yl]-2-[2-(dimethylamino)ethoxy]phenyl]propanamide, SULFATE ION, ... (6 entities in total)
• 機能のキーワード: her2, egfr, covalent inhibitors, transferase
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 77699.82

構造登録者

Niggenaber, J.,Mueller, M.P.,Rauh, D. (登録日: 2019-11-14, 公開日: 2020-09-30, 最終更新日: 2024-01-24)

• 主引用文献: Lategahn, J.,Hardick, J.,Grabe, T.,Niggenaber, J.,Jeyakumar, K.,Keul, M.,Tumbrink, H.L.,Becker, C.,Hodson, L.,Kirschner, T.,Klovekorn, P.,Ketzer, J.,Baumann, M.,Terheyden, S.,Unger, A.,Weisner, J.,Muller, M.P.,van Otterlo, W.A.L.,Bauer, S.,Rauh, D.; Targeting Her2-insYVMA with Covalent Inhibitors-A Focused Compound Screening and Structure-Based Design Approach.; J.Med.Chem., 63:11725-11755, 2020; PubMed: 32931277; DOI: 10.1021/acs.jmedchem.0c00870

実験手法

X-RAY DIFFRACTION (2 Å)