1Q1M

A Highly Efficient Approach to a Selective and Cell Active PTP1B inhibitors

1Q1M の概要

• エントリーDOI: 10.2210/pdb1q1m/pdb
• 関連するPDBエントリー: 1NL9 1NNY 1NO6 1NZ7 1ONY 1PHO
• 分子名称: Protein-tyrosine phosphatase, non-receptor type 1, 5-{2-FLUORO-5-[3-(3-HYDROXY-2-METHOXYCARBONYL-PHENOXY)-PROPENYL]-PHENYL}-ISOXAZOLE-3-CARBOXYLIC ACID (3 entities in total)
• 機能のキーワード: protein tyrosine phosphatase 1b, ptp1b, inhibitors with isoxazole-salicylate pharmacophores, hydrolase
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Endoplasmic reticulum membrane ; Peripheral membrane protein ; Cytoplasmic side : P18031
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 37778.99

構造登録者

Liu, G.,Xin, Z.,Pei, Z.,Hajduk, P.J.,Abad-Zapatero, C.,Hutchins, C.W.,Zhao, H.,Lubben, T.H.,Ballaron, S.J.,Haasch, D.L.,Kaszubska, W.,Rondinone, C.M.,Trevillyan, J.M.,Jirousek, M.R. (登録日: 2003-07-22, 公開日: 2003-09-16, 最終更新日: 2023-08-16)

• 主引用文献: Liu, G.,Xin, Z.,Pei, Z.,Hajduk, P.J.,Abad-Zapatero, C.,Hutchins, C.W.,Zhao, H.,Lubben, T.H.,Ballaron, S.J.,Haasch, D.L.,Kaszubska, W.,Rondinone, C.M.,Trevillyan, J.M.,Jirousek, M.R.; Fragment screening and assembly: a highly efficient approach to a selective and cell active protein tyrosine phosphatase 1B inhibitor.; J.Med.Chem., 46:4232-4235, 2003; PubMed: 13678400; DOI: 10.1021/jm034122o

実験手法

X-RAY DIFFRACTION (2.6 Å)