4FAD

Design and Synthesis of a Novel Pyrrolidinyl Pyrido Pyrimidinone Derivative as a Potent Inhibitor of PI3Ka and mTOR

4FAD の概要

• エントリーDOI: 10.2210/pdb4fad/pdb
• 関連するPDBエントリー: 4FA6
• 分子名称: Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, 2-amino-6-(5-fluoro-6-methoxypyridin-3-yl)-4-methyl-8-(pyrrolidin-1-yl)pyrido[2,3-d]pyrimidin-7(8H)-one (3 entities in total)
• 機能のキーワード: phosphoinositide kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Cytoplasm: P48736
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 111097.48

構造登録者

Greasley, S.E.,Knighton, D.R.,LaFleur Rogers, C.M. (登録日: 2012-05-22, 公開日: 2013-04-03, 最終更新日: 2024-02-28)

• 主引用文献: Le, P.T.,Cheng, H.,Ninkovic, S.,Plewe, M.,Huang, X.,Wang, H.,Bagrodia, S.,Sun, S.,Knighton, D.R.,LaFleur Rogers, C.M.,Pannifer, A.,Greasley, S.,Dalvie, D.,Zhang, E.; Design and synthesis of a novel pyrrolidinyl pyrido pyrimidinone derivative as a potent inhibitor of PI3Kalpha and mTOR; Bioorg.Med.Chem.Lett., 22:5098-5103, 2012; PubMed: 22749419; DOI: 10.1016/j.bmcl.2012.05.100

実験手法

X-RAY DIFFRACTION (2.7 Å)