5CM7

Structure of thiamine-monophosphate kinase from Acinetobacter baumannii in complex with adenosine diphosphate (ADP) and thiamine diphosphate (TPP)

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Thiamine-monophosphate kinase	polymer	313	34360.0	2	UniProt (A0A0D5YC82) Pfam (PF00586) Pfam (PF02769) In PDB	Acinetobacter baumannii	Thiamine-phosphate kinase
2	A, B	ADENOSINE-5'-DIPHOSPHATE	non-polymer		427.2	2	Chemie (ADP)
3	A, B	CALCIUM ION	non-polymer		40.1	6	Chemie (CA)
4	A, B	MAGNESIUM ION	non-polymer		24.3	4	Chemie (MG)
5	A, B	SODIUM ION	non-polymer		23.0	2	Chemie (NA)
6	A, B	THIAMINE DIPHOSPHATE	non-polymer		425.3	2	Chemie (TPP)
7		water	water		18.0	777	Chemie (HOH)

Sequence modifications

A, B: 1 - 305 (UniProt: A0A0D5YC82)

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

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	68720.0
Non-Polymers*	Number of molecules	16
	Total formula weight	2088.7
All*	Total formula weight	70808.7

*Water molecules are not included.