Title : Ligand release mechanisms and channels in histone deacetylases.

Pub. Date : 2013 Oct 5

PMID : 23893931






1 Functional Relationships(s)
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1 In this work, we perform hybrid classical molecular dynamics and random acceleration molecular dynamics simulations to explore the B3N [i.e., (4-(dimethylamino)N-[7(hydroxyamino)-7-oxoheptyle] benzamide)] exit channels in the x-ray crystal structures of HDAC3 and HDAC8 enzymes. 4-(dimethylamino)n-[7(hydroxyamino)-7-oxoheptyle] benzamide histone deacetylase 8 Homo sapiens