3ZI0

Structure of Mycobacterium tuberculosis DXR in complex with a fosmidomycin analogue

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)	1-DEOXY-D-XYLULOSE 5-PHOSPHATE REDUCTOISOMERASE	polymer	397	41599.9	2	UniProt (P64012) Pfam (PF02670) Pfam (PF08436) Pfam (PF13288) UniProt (by SIFTS) (P9WNS1)	MYCOBACTERIUM TUBERCULOSIS	DXP REDUCTOISOMERASE, 1-DEOXYXYLULOSE-5-PHOSPHATE REDUCTOISOMERASE, 2-C-METHYL-D-ERYTHRITOL 4-PHOSPHATE SYNTHASE
2	C (A)	[(1S)-1-(3,4-dichlorophenyl)-3-{hydroxy[2-(1H-1,2,4-triazol-1-ylmethyl)benzoyl]amino}propyl]phosphonic acid	non-polymer		485.3	1	Chemie (FM8)
3	D (B)	MANGANESE (II) ION	non-polymer		54.9	1	Chemie (MN)
4	E, F (A, B)	water	water		18.0	155	Chemie (HOH)

Sequence modifications

A, B: 2 - 389 (UniProt: P64012)

PDB	External Database	Details
Met -7	-	expression tag
Ala -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
Val 1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	83199.7
Non-Polymers*	Number of molecules	2
	Total formula weight	540.2
All*	Total formula weight	83739.9

*Water molecules are not included.