6J1L

Crystal Structure Analysis of the ROR gamma(C455E)

Summary for 6J1L

• Entry DOI: 10.2210/pdb6j1l/pdb
• Descriptor: Nuclear receptor ROR-gamma, 2-[4-(ethylsulfonyl)phenyl]-N-[2'-fluoro-4'-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)[1,1'-biphenyl]-4-yl]acetamide (3 entities in total)
• Functional Keywords: ror gamma, lbd, inhibitor, dna binding protein
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 3
• Total formula weight: 95077.23

Authors

zhang, Y.,Li, C.C.,wu, X.S. (deposition date: 2018-12-28, release date: 2019-05-01, Last modification date: 2023-11-22)

• Primary citation: Zhang, Y.,Wu, X.,Xue, X.,Li, C.,Wang, J.,Wang, R.,Zhang, C.,Wang, C.,Shi, Y.,Zou, L.,Li, Q.,Huang, Z.,Hao, X.,Loomes, K.,Wu, D.,Chen, H.W.,Xu, J.,Xu, Y.; Discovery and Characterization of XY101, a Potent, Selective, and Orally Bioavailable ROR gamma Inverse Agonist for Treatment of Castration-Resistant Prostate Cancer.; J.Med.Chem., 62:4716-4730, 2019; PubMed: 30964293; DOI: 10.1021/acs.jmedchem.9b00327

Experimental method

X-RAY DIFFRACTION (2.3 Å)