1XUO

X-ray structure of LFA-1 I-domain bound to a 1,4-diazepane-2,5-dione inhibitor at 1.8A resolution

1XUO の概要

• エントリーDOI: 10.2210/pdb1xuo/pdb
• 関連するPDBエントリー: 1CQP 1XDD 1XDG
• 分子名称: Integrin alpha-L, MAGNESIUM ION, (2R)-2-[3-ISOBUTYL-2,5-DIOXO-4-(QUINOLIN-3-YLMETHYL)-1,4-DIAZEPAN-1-YL]-N-METHYL-3-(2-NAPHTHYL)PROPANAMIDE, ... (4 entities in total)
• 機能のキーワード: i-domain, integrin, immune system
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Membrane; Single-pass type I membrane protein: P20701
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 43436.40

構造登録者

Wattanasin, S.,Kallen, J.,Myers, S.,Guo, Q.,Sabio, M.,Ehrhardt, C.,Albert, R.,Hommel, U.,Weckbecker, G.,Welzenbach, K. (登録日: 2004-10-26, 公開日: 2005-10-26, 最終更新日: 2024-03-20)

主引用文献

Wattanasin, S.,Kallen, J.,Myers, S.,Guo, Q.,Sabio, M.,Ehrhardt, C.,Albert, R.,Hommel, U.,Weckbecker, G.,Welzenbach, K.,Weitz-Schmidt, G.
1,4-Diazepane-2,5-diones as novel inhibitors of LFA-1
Bioorg.Med.Chem.Lett., 15:1217-1220, 2005

PubMed Abstract: 1,4-Diazepane-2,5-diones (2) are found to be a new class of potent LFA-1 inhibitors. The synthesis, structure, and biological evaluation of these 1,4-diazepine-2,5-diones and related derivatives are described.

PubMed: 15686945
DOI: 10.1016/j.bmcl.2004.11.072

実験手法

X-RAY DIFFRACTION (1.8 Å)