3WFF

Mineralocorticoid receptor ligand-binding domain with compound 2b

3WFF の概要

• エントリーDOI: 10.2210/pdb3wff/pdb
• 関連するPDBエントリー: 3VHU 3VHV 3WFG
• 分子名称: Mineralocorticoid receptor, 6-[4-(2,4-difluorophenyl)-5-oxo-2,5-dihydrofuran-3-yl]-2H-1,4-benzoxazin-3(4H)-one, PHOSPHATE ION, ... (4 entities in total)
• 機能のキーワード: nuclear receptor, transcription factor, transcription, hypertension, non-steroidal antagonist, activating mutation, transcription-inhibitor complex, transcription/inhibitor
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 32102.90

構造登録者

Sogabe, S.,Habuka, N. (登録日: 2013-07-19, 公開日: 2013-08-21, 最終更新日: 2023-11-08)

• 主引用文献: Hasui, T.,Ohra, T.,Ohyabu, N.,Asano, K.,Matsui, H.,Mizukami, A.,Habuka, N.,Sogabe, S.,Endo, S.,Siedem, C.S.,Tang, T.P.,Gauthier, C.,De Meese, L.A.,Boyd, S.A.,Fukumoto, S.; Design, synthesis, and structure-activity relationships of dihydrofuran-2-one and dihydropyrrol-2-one derivatives as novel benzoxazin-3-one-based mineralocorticoid receptor antagonists.; Bioorg.Med.Chem., 21:5983-5994, 2013; PubMed: 23958516; DOI: 10.1016/j.bmc.2013.07.043

実験手法

X-RAY DIFFRACTION (2.05 Å)