2X1H

Crystal structure of the human MGC45594 gene product in complex with raloxifene

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)	ZINC-BINDING ALCOHOL DEHYDROGENASE DOMAIN-CONTAINING PROTEIN 2	polymer	362	38722.4	2	UniProt (Q8N4Q0) Pfam (PF08240) Pfam (PF00107)	HOMO SAPIENS (HUMAN)	MGC45594 GENE PRODUCT
2	C, D, E, I (A, B)	1,2-ETHANEDIOL	non-polymer		62.1	4	Chemie (EDO)
3	F, J (A, B)	NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE	non-polymer		743.4	2	Chemie (NAP)
4	G, H, K, L (A, B)	[6-HYDROXY-2-(4-HYDROXYPHENYL)-1-BENZOTHIOPHEN-3-YL](4-METHOXYPHENYL)METHANONE	non-polymer		376.4	4	Chemie (X1H)
5	M, N (A, B)	water	water		18.0	582	Chemie (HOH)

Sequence modifications

A, B: 24 - 362 (UniProt: Q8N4Q0)

PDB	External Database	Details
Met 1	-	expression tag
His 2	-	expression tag
His 3	-	expression tag
His 4	-	expression tag
His 5	-	expression tag
His 6	-	expression tag
His 7	-	expression tag
Ser 8	-	expression tag
Ser 9	-	expression tag
Gly 10	-	expression tag
Val 11	-	expression tag
Asp 12	-	expression tag
Leu 13	-	expression tag
Gly 14	-	expression tag
Thr 15	-	expression tag
Glu 16	-	expression tag
Asn 17	-	expression tag
Leu 18	-	expression tag
Tyr 19	-	expression tag
Phe 20	-	expression tag
Gln 21	-	expression tag
Ser 22	-	expression tag
Met 23	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	77444.8
Non-Polymers*	Number of molecules	10
	Total formula weight	3240.8
All*	Total formula weight	80685.6

*Water molecules are not included.