Enolization as an alternative proton delivery pathway in human aromatase (P450 19A1)

Journal of Physical Chemistry B

Volumn 118, Issue 2, 2014, Pages 390-405

  Krámos, Balázs ^a   Oláh, Julianna ^a  

^a BUDAPEST UNIVERSITY OF TECHNOLOGY AND ECONOMICS   (Hungary)

Author keywords

[No Author keywords available]

Indexed keywords

COUPLED PROCESS; HYBRID QM/MM; P450 ENZYMES; PEROXOCOMPLEXES; PROTON DELIVERY; QUANTUM MECHANICAL; REACTION MECHANISM; SUPEROXO COMPLEX;

BIOCHEMISTRY; CATALYSIS; IRON; QUANTUM THEORY;

PROTONATION;

ANDROSTENEDIONE; AROMATASE; ESTRONE; PROTON;

BINDING SITE; BIOCATALYSIS; CHEMISTRY; ENTROPY; HUMAN; METABOLISM; MOLECULAR DYNAMICS; PROTEIN TERTIARY STRUCTURE; QUANTUM THEORY;

ANDROSTENEDIONE; AROMATASE; BINDING SITES; BIOCATALYSIS; ENTROPY; ESTRONE; HUMANS; MOLECULAR DYNAMICS SIMULATION; PROTEIN STRUCTURE, TERTIARY; PROTONS; QUANTUM THEORY;

EID: 84892738164     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp407365x     Document Type: Article

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