6ESN

Ligand complex of RORg LBD

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Nuclear receptor ROR-gamma	polymer	267	31032.6	1	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	C	LYS-HIS-LYS-ILE-LEU-HIS-ARG-LEU-LEU-GLN-ASP-SER	polymer	12	1492.8	1	UniProt (by SIFTS) (Q15596) In PDB	Homo sapiens
3	A	(2~{R})-2-acetamido-~{N}-[4-(5-cyano-3-fluoranyl-2-methoxy-phenyl)thiophen-2-yl]-2-(4-ethylsulfonylphenyl)ethanamide	non-polymer		515.6	1	Chemie (BWE)
4	A	SODIUM ION	non-polymer		23.0	1	Chemie (NA)
5		water	water		18.0	258	Chemie (HOH)

Sequence modifications

A: 265 - 507 (UniProt: P51449)

PDB	External Database	Details
Met 243	-	initiating methionine
His 244	-	expression tag
Asn 245	-	expression tag
His 246	-	expression tag
Asn 247	-	expression tag
His 248	-	expression tag
Asn 249	-	expression tag
His 250	-	expression tag
Asn 251	-	expression tag
His 252	-	expression tag
Asn 253	-	expression tag
His 254	-	expression tag
Asn 255	-	expression tag
Gly 256	-	expression tag
Gly 257	-	expression tag
Glu 258	-	expression tag
Asn 259	-	expression tag
Leu 260	-	expression tag
Tyr 261	-	expression tag
Phe 262	-	expression tag
Gln 263	-	expression tag
Gly 264	-	expression tag
Gly 508	-	expression tag
Gly 509	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	32525.4
Non-Polymers*	Number of molecules	2
	Total formula weight	538.6
All*	Total formula weight	33063.9

*Water molecules are not included.