7OFK

Ligand complex of RORg LBD

7OFK の概要

• エントリーDOI: 10.2210/pdb7ofk/pdb
• 分子名称: Nuclear receptor ROR-gamma, Nuclear receptor coactivator 2, (1~{R})-2-ethanoyl-~{N}-[4-[1,1,1,3,3,3-hexakis(fluoranyl)-2-oxidanyl-propan-2-yl]phenyl]-5-methylsulfonyl-1,3-dihydroisoindole-1-carboxamide, ... (6 entities in total)
• 機能のキーワード: nuclear hormone receptor autoimmunity small molecule inhibitor inverse agonist ligand binding domain, signaling protein
• 由来する生物種: Homo sapiens (Human); 詳細
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 33500.30

構造登録者

Xue, Y.,Aagaard, A.,Narjes, F. (登録日: 2021-05-05, 公開日: 2022-03-16, 最終更新日: 2024-01-31)

• 主引用文献: Narjes, F.,Llinas, A.,von Berg, S.,Jirholt, J.,Lever, S.,Pehrson, R.,Collins, M.,Malmberg, A.,Svanberg, P.,Xue, Y.,Olsson, R.I.,Malmberg, J.,Hughes, G.,Hossain, N.,Grindebacke, H.,Leffler, A.,Krutrok, N.,Back, E.,Ramnegard, M.,Lepisto, M.,Thunberg, L.,Aagaard, A.,McPheat, J.,Hansson, E.L.,Chen, R.,Xiong, Y.,Hansson, T.G.; AZD0284, a Potent, Selective, and Orally Bioavailable Inverse Agonist of Retinoic Acid Receptor-Related Orphan Receptor C2.; J.Med.Chem., 64:13807-13829, 2021; PubMed: 34464130; DOI: 10.1021/acs.jmedchem.1c01197

実験手法

X-RAY DIFFRACTION (1.61 Å)