3T6Y

5'-Diphenyl Nucleoside Inhibitors of Plasmodium falciparum dUTPase

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C	Deoxyuridine 5'-triphosphate nucleotidohydrolase, putative	polymer	181	20632.2	3	UniProt (Q8II92) Pfam (PF00692) In PDB	Plasmodium falciparum
2	F	peptide ALA-HIS-ALA	polymer	3	298.3	1		synthetic construct
3	A, B, C	2',5'-dideoxy-5'-{[(R)-(1-methyl-1H-imidazol-2-yl)(phenyl)methyl]amino}uridine	non-polymer		397.4	3	Chemie (DU2)
4	A, B, C	SULFATE ION	non-polymer		96.1	5	Chemie (SO4)
5		water	water		18.0	127	Chemie (HOH)

Sequence modifications

A, B, C: 1 - 173 (UniProt: Q8II92)

PDB	External Database	Details
Glu 174	-	expression tag
Ala 175	-	expression tag
His 176	-	expression tag
His 177	-	expression tag
His 178	-	expression tag
His 179	-	expression tag
His 180	-	expression tag
His 181	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	62195.1
Non-Polymers*	Number of molecules	8
	Total formula weight	1672.6
All*	Total formula weight	63867.7

*Water molecules are not included.