4X3J

Selection of fragments for kinase inhibitor design: decoration is key

4X3J の概要

• エントリーDOI: 10.2210/pdb4x3j/pdb
• 分子名称: Angiopoietin-1 receptor, 1-[4-(4-amino-5-oxopyrido[2,3-d]pyrimidin-8(5H)-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea (3 entities in total)
• 機能のキーワード: transferase, protein kinase, inhibitor complex
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Cell membrane; Single-pass type I membrane protein: Q02763
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 37252.40

構造登録者

Czodrowski, P.,Hoelzemann, G.,Barnickel, G.,Greiner, H.,Musil, D. (登録日: 2014-11-30, 公開日: 2014-12-24, 最終更新日: 2024-05-08)

• 主引用文献: Czodrowski, P.,Holzemann, G.,Barnickel, G.,Greiner, H.,Musil, D.; Selection of fragments for kinase inhibitor design: decoration is key.; J.Med.Chem., 58:457-465, 2015; PubMed: 25437144; DOI: 10.1021/jm501597j

実験手法

X-RAY DIFFRACTION (2.5 Å)