8QGI

Crystal structure of NAD kinase 1 from Listeria monocytogenes in complex with a di-adenosine derivative

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	NAD kinase 1	polymer	272	31045.3	1	UniProt (Q8Y8D7) Pfam (PF01513) Pfam (PF20143)	Listeria monocytogenes EGD-e	ATP-dependent NAD kinase
2	B (A)	CITRIC ACID	non-polymer		192.1	1	Chemie (CIT)
3	C (A)	1-[[(2~{R},3~{S},4~{R},5~{R})-5-[8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-(3-azanylpropyl)amino]prop-1-ynyl]-6-azanyl-purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-3-(phenylmethyl)urea	non-polymer		758.8	1	Chemie (UZO)
4	D (A)	water	water		18.0	118	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	950.9
All*	Total formula weight	31996.2

*Water molecules are not included.