Theoretical study revealing the functioning of a novel combination of catalytic motifs in histone deacetylase

Bioorganic and Medicinal Chemistry

Volumn 13, Issue 12, 2005, Pages 3987-3992

  Vanommeslaeghe, K ^a   De Proft, F ^a   Loverix, S ^a,b   Tourwe D ^a   Geerlings, P ^a  

^a VRIJE UNIVERSITEIT BRUSSEL   (Belgium)

^b DEPARTMENT OF PLANT SYSTEMS BIOLOGY   (Belgium)

Author keywords

Density functional theory; Enzyme catalysis; Histone deacetylase; Protonation state

Indexed keywords

ASPARTIC ACID; HISTIDINE; HISTONE DEACETYLASE; WATER;

ARTICLE; CATALYSIS; COMPARATIVE STUDY; DENSITY FUNCTIONAL THEORY; ENZYME ACTIVE SITE; PROTON TRANSPORT; THEORETICAL STUDY;

AMINO ACID MOTIFS; ANTINEOPLASTIC AGENTS; ASPARTIC ACID; BINDING SITES; CATALYSIS; CATALYTIC DOMAIN; HISTIDINE; HISTONE DEACETYLASES; MODELS, MOLECULAR; PROTONS; WATER;

EID: 19444379914     PISSN: 09680896     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmc.2005.04.001     Document Type: Article

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