4DY6

Crystal structure of NAD kinase 1 from Listeria monocytogenes in complex with 2'-phosphate bis(adenosine)-5'-diphosphate

Replaces:  2I2E

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	inorganic polyphosphate/ATP-NAD kinase 1	polymer	272	31045.3	1	UniProt (Q8Y8D7) Pfam (PF01513) Pfam (PF20143)	Listeria monocytogenes	Poly(P)/ATP NAD kinase 1
2	B (A)	[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL]METHYL [(2R,3R,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3-HYDROXY-4-(PHOSPHONOOXY)TETRAHYDROFURAN-2-YL]METHYL DIHYDROGEN DIPHOSPHATE	non-polymer		756.4	1	Chemie (A22)
3	C (A)	CITRIC ACID	non-polymer		192.1	1	Chemie (CIT)
4	D (A)	water	water		18.0	100	Chemie (HOH)

Sequence modifications

A: 1 - 264 (UniProt: Q8Y8D7)

PDB	External Database	Details
Leu 265	-	expression tag
Glu 266	-	expression tag
His 267	-	expression tag
His 268	-	expression tag
His 269	-	expression tag
His 270	-	expression tag
His 271	-	expression tag
His 272	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	31045.3
Non-Polymers*	Number of molecules	2
	Total formula weight	948.5
All*	Total formula weight	31993.8

*Water molecules are not included.