5LD8

GSK3011724A cocrystallised with Mycobacterium tuberculosis H37Rv KasA

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	3-oxoacyl-[acyl-carrier-protein] synthase 1	polymer	435	45400.1	2	UniProt (P9WQD9) Pfam (PF00109) Pfam (PF02801) In PDB	Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)	Beta-ketoacyl-ACP synthase 1,KAS 1
2	A, B	SODIUM ION	non-polymer		23.0	2	Chemie (NA)
3	A, B	~{N}-(1-methylindazol-6-yl)butane-1-sulfonamide	non-polymer		267.3	2	Chemie (6U5)
4	A	TETRAETHYLENE GLYCOL	non-polymer		194.2	2	Chemie (PG4)
5		water	water		18.0	365	Chemie (HOH)

Sequence modifications

A, B: 2 - 416 (UniProt: P9WQD9)

PDB	External Database	Details
Met -18	-	initiating methionine
Gly -17	-	expression tag
Ser -16	-	expression tag
Ser -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
His -10	-	expression tag
His -9	-	expression tag
Ser -8	-	expression tag
Ser -7	-	expression tag
Gly -6	-	expression tag
Leu -5	-	expression tag
Val -4	-	expression tag
Pro -3	-	expression tag
Arg -2	-	expression tag
Gly -1	-	expression tag
Ser 0	-	expression tag
His 1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	90800.3
Non-Polymers*	Number of molecules	6
	Total formula weight	969.1
All*	Total formula weight	91769.4

*Water molecules are not included.