3IPQ

X-ray structure of GW3965 synthetic agonist bound to the LXR-alpha

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Oxysterols receptor LXR-alpha	polymer	283	32866.4	1	UniProt (Q13133) Pfam (PF00104)	Homo sapiens (human)	Liver X receptor alpha, Nuclear orphan receptor LXR-alpha, Nuclear receptor subfamily 1 group H member 3
2	B (B)	Nuclear receptor coactivator 1	polymer	25	2806.2	1	UniProt (Q15788) Pfam (PF08832)		NCoA-1, Steroid receptor coactivator 1, SRC-1, RIP160, Protein Hin-2, Renal carcinoma antigen NY-REN-52
3	C (A)	[3-(3-{[2-chloro-3-(trifluoromethyl)benzyl](2,2-diphenylethyl)amino}propoxy)phenyl]acetic acid	non-polymer		582.1	1	Chemie (965)
4	D (B)	SULFATE ION	non-polymer		96.1	1	Chemie (SO4)
5	E, F (A, B)	water	water		18.0	118	Chemie (HOH)

Sequence modifications

A: 182 - 447 (UniProt: Q13133)

PDB	External Database	Details
Met 165	-	expression tag
Lys 166	-	expression tag
His 167	-	expression tag
Gln 168	-	expression tag
His 169	-	expression tag
Gln 170	-	expression tag
His 171	-	expression tag
Gln 172	-	expression tag
His 173	-	expression tag
Gln 174	-	expression tag
His 175	-	expression tag
Gln 176	-	expression tag
His 177	-	expression tag
Gln 178	-	expression tag
Gln 179	-	expression tag
Pro 180	-	expression tag
Leu 181	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	35672.6
Non-Polymers*	Number of molecules	2
	Total formula weight	678.1
All*	Total formula weight	36350.7

*Water molecules are not included.