6UCG

Retinoic acid receptor-related orphan receptor (ROR) gamma in complex with allosteric compound 28

Summary for 6UCG

• Entry DOI: 10.2210/pdb6ucg/pdb
• Related: 5C4T
• Descriptor: Nuclear receptor ROR-gamma, (3S,4R)-1-[1-(2-chloro-6-cyclopropylbenzene-1-carbonyl)-4-fluoro-1H-indazol-3-yl]-3-hydroxypiperidine-4-carboxylic acid (3 entities in total)
• Functional Keywords: ror gamma t, allosteric, nuclear receptor, transcription
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 1
• Total formula weight: 28642.55

Authors

Palte, R.L.,Parthasarathy, G. (deposition date: 2019-09-16, release date: 2020-03-04, Last modification date: 2024-03-13)

• Primary citation: Zhang, H.,Lapointe, B.T.,Anthony, N.,Azevedo, R.,Cals, J.,Correll, C.C.,Daniels, M.,Deshmukh, S.,van Eenenaam, H.,Ferguson, H.,Hegde, L.G.,Karstens, W.J.,Maclean, J.,Miller, J.R.,Moy, L.Y.,Simov, V.,Nagpal, S.,Oubrie, A.,Palte, R.L.,Parthasarathy, G.,Sciammetta, N.,van der Stelt, M.,Woodhouse, J.D.,Trotter, B.W.,Barr, K.; Discovery ofN-(Indazol-3-yl)piperidine-4-carboxylic Acids as ROR gamma t Allosteric Inhibitors for Autoimmune Diseases.; Acs Med.Chem.Lett., 11:114-119, 2020; PubMed: 32071676; DOI: 10.1021/acsmedchemlett.9b00431

Experimental method

X-RAY DIFFRACTION (2.87 Å)