4WLB

Crystal structure of RORc in complex with a partial inverse agonist compound

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	Nuclear receptor ROR-gamma	polymer	265	30853.5	2	UniProt (P51449) Pfam (PF00104)	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	C, D (D, E)	SRC-1 peptide	polymer	8	931.2	2		Homo sapiens
3	E, H (A, B)	N-(4-fluorobenzyl)-N-(2-methylpropyl)-6-{[1-(methylsulfonyl)piperidin-4-yl]amino}pyridine-3-sulfonamide	non-polymer		498.6	2	Chemie (3QQ)
4	F, G (A)	L(+)-TARTARIC ACID	non-polymer		150.1	2	Chemie (TLA)
5	I, J, K, L (A, B, D, E)	water	water		18.0	425	Chemie (HOH)

Sequence modifications

A, B: 262 - 507 (UniProt: P51449)

PDB	External Database	Details
Met 246	-	expression tag
His 247	-	expression tag
His 248	-	expression tag
His 249	-	expression tag
His 250	-	expression tag
His 251	-	expression tag
His 252	-	expression tag
Gly 253	-	expression tag
Glu 254	-	expression tag
Asn 255	-	expression tag
Leu 256	-	expression tag
Tyr 257	-	expression tag
Phe 258	-	expression tag
Gln 259	-	expression tag
Gly 260	-	expression tag
Ser 261	-	expression tag
Gly 508	-	expression tag
Asn 509	-	expression tag
Ser 510	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	63569.3
Non-Polymers*	Number of molecules	4
	Total formula weight	1297.4
All*	Total formula weight	64866.8

*Water molecules are not included.