7ZM3

Crystal structure of HsaD from Mycobacterium tuberculosis in complex with Cyclipostin-like inhibitor CyC17

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)	4,5:9,10-diseco-3-hydroxy-5,9,17-trioxoandrosta-1(10),2-diene-4-oate hydrolase	polymer	299	32986.6	2	UniProt (P9WNH5) Pfam (PF00561)	Mycobacterium tuberculosis H37Rv	2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoate hydrolase,HOPDA hydrolase,Meta-cleavage product hydrolase,MCP hydrolase
2	C, E (A, B)	hexadecyl dihydrogen phosphate	non-polymer		322.4	2	Chemie (E9H)
3	D, F (A, B)	SULFATE ION	non-polymer		96.1	2	Chemie (SO4)
4	G, H (A, B)	water	water		18.0	336	Chemie (HOH)

Sequence modifications

A, B: 1 - 291 (UniProt: P9WNH5)

PDB	External Database	Details
Lys 292	-	expression tag
Leu 293	-	expression tag
His 294	-	expression tag
His 295	-	expression tag
His 296	-	expression tag
His 297	-	expression tag
His 298	-	expression tag
His 299	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	65973.2
Non-Polymers*	Number of molecules	4
	Total formula weight	837.0
All*	Total formula weight	66810.2

*Water molecules are not included.