6BR2

Structure of RORgt in complex with a novel isoquinoline inverse agonist.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Nuclear receptor ROR-gamma	polymer	215	25000.9	2	UniProt (P51449) Pfam (PF00104) In PDB	Homo sapiens (Human)	Nuclear receptor RZR-gamma,Nuclear receptor subfamily 1 group F member 3,RAR-related orphan receptor C,Retinoid-related orphan receptor-gamma
2	A, B	(4S)-2-METHYL-2,4-PENTANEDIOL	non-polymer		118.2	2	Chemie (MPD)
3	A, B	(1R)-N-(4-tert-butyl-3-fluorophenyl)-6-methoxy-2-[(3-oxo-2,3-dihydro-1,2-oxazol-5-yl)acetyl]-1,2,3,4-tetrahydroisoquinoline-1-carboxamide	non-polymer		481.5	2	Chemie (E3S)
4		water	water		18.0	18	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	50001.8
Non-Polymers*	Number of molecules	4
	Total formula weight	1199.4
All*	Total formula weight	51201.2

*Water molecules are not included.