5AYG

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

Summary for 5AYG

Entry DOI	10.2210/pdb5ayg/pdb
Descriptor	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)
Functional Keywords	inhibitor, complex, nuclear receptor, dna binding protein-inhibitor complex, dna binding protein/inhibitor
Biological source	Homo sapiens (Human)
Total number of polymer chains	2
Total formula weight	60606.13
Authors	Noguchi, M.,Doi, S.,Nomura, A.,Kikuwaka, M.,Murase, K.,Hirata, K.,Kamada, M.,Adachi, T. (deposition date: 2015-08-20, release date: 2016-03-02, Last modification date: 2023-11-08)
Primary citation	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 Cited by PubMed: 26819660 DOI: 10.1021/acsmedchemlett.5b00253 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.6 Å)

Structure validation