5TE1

C20S, C293G Mutant N-terminal Human ATP Citrate Lyase Bound to 4R-Hydroxycitrate

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)	ATP-citrate synthase	polymer	828	90611.5	2	UniProt (P53396) Pfam (PF16114) Pfam (PF02629) Pfam (PF00549)	Homo sapiens (Human)	ATP-citrate (pro-S-)-lyase,ACL,Citrate cleavage enzyme
2	C, F (A, B)	3-C-carboxy-2-deoxy-L-threo-pentaric acid	non-polymer		208.1	2	Chemie (7A2)
3	D, G (A, B)	PHOSPHATE ION	non-polymer		95.0	2	Chemie (PO4)
4	E, H (A, B)	SODIUM ION	non-polymer		23.0	2	Chemie (NA)
5	I, J (A, B)	water	water		18.0	750	Chemie (HOH)

Sequence modifications

A, B: 1 - 817 (UniProt: P53396)

PDB	External Database	Details
Ser 20	Cys 20	engineered mutation
Gly 293	Cys 293	engineered mutation
Ala 818	-	expression tag
Ala 819	-	expression tag
Leu 820	-	expression tag
Glu 821	-	expression tag
His 822	-	expression tag
His 823	-	expression tag
His 824	-	expression tag
His 825	-	expression tag
His 826	-	expression tag
His 827	-	expression tag
His 828	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	181223.0
Non-Polymers*	Number of molecules	6
	Total formula weight	652.2
All*	Total formula weight	181875.2

*Water molecules are not included.