3R0I

IspC in complex with an N-methyl-substituted hydroxamic acid

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	1-deoxy-D-xylulose 5-phosphate reductoisomerase	polymer	410	44837.4	2	UniProt (P45568) Pfam (PF02670) Pfam (PF08436) Pfam (PF13288) In PDB	Escherichia coli K-12	DXP reductoisomerase, 1-deoxyxylulose-5-phosphate reductoisomerase, 2-C-methyl-D-erythritol 4-phosphate synthase
2	A, B	MANGANESE (II) ION	non-polymer		54.9	2	Chemie (MN)
3	A, B	{(1S)-1-(3,4-difluorophenyl)-4-[hydroxy(methyl)amino]-4-oxobutyl}phosphonic acid	non-polymer		309.2	2	Chemie (C0K)
4		water	water		18.0	773	Chemie (HOH)

Sequence modifications

A, B: 1 - 398 (UniProt: P45568)

PDB	External Database	Details
Met -11	-	expression tag
Arg -10	-	expression tag
Gly -9	-	expression tag
Ser -8	-	expression tag
His -7	-	expression tag
His -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
Gly -1	-	expression tag
Ser 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	89674.8
Non-Polymers*	Number of molecules	4
	Total formula weight	728.3
All*	Total formula weight	90403.1

*Water molecules are not included.