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Interactions of curcumin with the PfATP6 model and the implications for its antimalarial mechanism.

Abstract：

:Despite curcumin has been proved to possess antimalarial effects, the underlying mechanism remains to be elucidated. In this letter, the active site binding modes of curcumin in PfATP6, an important antimalarial target, were investigated using computational docking. It was revealed that curcumin interacts with PfATP6 mainly through hydrophobic interactions and hydrogen bonds. Moreover, the theoretically predicted binding affinity implies that curcumin can efficiently inhibit PfATP6, which gains some deeper insights into the antimalarial mechanism of curcumin.

journal_name

Bioorg Med Chem Lett

journal_title

Bioorganic & medicinal chemistry letters

authors

Ji HF,Shen L

doi

10.1016/j.bmcl.2009.03.060

subject

Has Abstract

pub_date

2009-05-01 00:00:00

pages

2453-5

issue

9

eissn

0960-894X

issn

1464-3405

pii

S0960-894X(09)00371-0

journal_volume

19

pub_type

杂志文章

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