Does the active site of mammalian glutathione peroxidase (GPx) contain water molecules? An ONIOM study

Journal of Physical Chemistry B

Volumn 108, Issue 34, 2004, Pages 12643-12645

  Prabhakar, Rajeev ^a   Musaev, Djamaladdin G ^a   Khavrutskii, Ilja V ^a   Morokuma, Keiji ^a  

^a EMORY UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

QUANTUM MECHANICAL (QM) METHODS; WATER MOLECULES; X-RAY STRUCTURES;

AMINO ACIDS; CATALYSIS; CRYSTAL STRUCTURE; DIMERS; ERROR ANALYSIS; MATHEMATICAL MODELS; MOLECULAR STRUCTURE; MONOMERS; QUANTUM THEORY; X RAY ANALYSIS;

ENZYMES;

EID: 4444273973     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp047303q     Document Type: Article

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