6R7D

Crystal structure of LTC4S in complex with AZ13690257

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C, D, E...	Leukotriene C4 synthase	polymer	157	17482.6	12	UniProt (Q16873) Pfam (PF01124) In PDB	Homo sapiens (Human)	LTC4 synthase,Leukotriene-C(4) synthase
2	C, H, I, D, J...	(1~{S},2~{S})-2-[5-[cyclopropylmethyl(naphthalen-1-yl)amino]-4-methoxy-pyrimidin-2-yl]carbonylcyclopropane-1-carboxylic acid	non-polymer		417.5	12	Chemie (JUQ)
3	C, I, D, J, A...	NICKEL (II) ION	non-polymer		58.7	8	Chemie (NI)
4	B, G, C, H, I...	PALMITIC ACID	non-polymer		256.4	43	Chemie (PLM)
5	B	DODECYL-BETA-D-MALTOSIDE	non-polymer		510.6	1	Chemie (LMT)
6		water	water		18.0	97	Chemie (HOH)

Sequence modifications

A, B, C, D, E, F, G, H, I, J, K, L: 2 - 150 (UniProt: Q16873)

PDB	External Database	Details
Met -6	-	initiating methionine
Ala -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
His 1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	12
	Total formula weight	209791.5
Non-Polymers*	Number of molecules	64
	Total formula weight	17015.9
All*	Total formula weight	226807.3

*Water molecules are not included.