6T4Y

ROR(gamma)t ligand binding domain in complex with 25-hydroxycholesterol and allosteric ligand MRL871

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Nuclear receptor ROR-gamma	polymer	263	30514.2	1	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	B (A)	25-HYDROXYCHOLESTEROL	non-polymer		402.7	1	Chemie (HC3)
3	C (A)	4-{1-[2-chloro-6-(trifluoromethyl)benzoyl]-1H-indazol-3-yl}benzoic acid	non-polymer		444.8	1	Chemie (4F1)
4	D (A)	GLYCEROL	non-polymer		92.1	1	Chemie (GOL)
5	E (A)	water	water		18.0	47	Chemie (HOH)

Sequence modifications

A: 265 - 507 (UniProt: P51449)

PDB	External Database	Details
Gly 245	-	expression tag
Ser 246	-	expression tag
Ser 247	-	expression tag
His 248	-	expression tag
His 249	-	expression tag
His 250	-	expression tag
His 251	-	expression tag
His 252	-	expression tag
His 253	-	expression tag
Ser 254	-	expression tag
Ser 255	-	expression tag
Gly 256	-	expression tag
Leu 257	-	expression tag
Val 258	-	expression tag
Pro 259	-	expression tag
Arg 260	-	expression tag
Gly 261	-	expression tag
Ser 262	-	expression tag
His 263	-	expression tag
Met 264	-	expression tag
His 455	Cys 455	conflict

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	30514.2
Non-Polymers*	Number of molecules	3
	Total formula weight	939.5
All*	Total formula weight	31453.7

*Water molecules are not included.