5AYG

Crystal Structure of the Human ROR gamma Ligand Binding Domain With 3g

5AYG の概要

• エントリーDOI: 10.2210/pdb5ayg/pdb
• 分子名称: Nuclear receptor ROR-gamma, 3-[5-(2-cyclohexylethyl)-4-ethyl-1,2,4-triazol-3-yl]-N-naphthalen-1-yl-propanamide (3 entities in total)
• 機能のキーワード: inhibitor, complex, nuclear receptor, dna binding protein-inhibitor complex, dna binding protein/inhibitor
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 60606.13

構造登録者

Noguchi, M.,Doi, S.,Nomura, A.,Kikuwaka, M.,Murase, K.,Hirata, K.,Kamada, M.,Adachi, T. (登録日: 2015-08-20, 公開日: 2016-03-02, 最終更新日: 2023-11-08)

• 主引用文献: Hirata, K.,Kotoku, M.,Seki, N.,Maeba, T.,Maeda, K.,Hirashima, S.,Sakai, T.,Obika, S.,Hori, A.,Hase, Y.,Yamaguchi, T.,Katsuda, Y.,Hata, T.,Miyagawa, N.,Arita, K.,Nomura, Y.,Asahina, K.,Aratsu, Y.,Kamada, M.,Adachi, T.,Noguchi, M.,Doi, S.,Crowe, P.,Bradley, E.,Steensma, R.,Tao, H.,Fenn, M.,Babine, R.,Li, X.,Thacher, S.,Hashimoto, H.,Shiozaki, M.; SAR Exploration Guided by LE and Fsp(3): Discovery of a Selective and Orally Efficacious ROR gamma Inhibitor; Acs Med.Chem.Lett., 7:23-27, 2016; PubMed: 26819660; DOI: 10.1021/acsmedchemlett.5b00253

実験手法

X-RAY DIFFRACTION (2.6 Å)