Catalytic roles of active-site residues in 2-methyl-3-hydroxypyridine-5- carboxylic acid oxygenase: An ONIOM/DFT study

Journal of Physical Chemistry B

Volumn 115, Issue 8, 2011, Pages 1918-1926

  Tian, Boxue ^a   Strid, Åke ^b   Eriksson, Leif A ^a  

^a NATIONAL UNIVERSITY OF IRELAND   (Ireland)

^b ÖREBRO UNIVERSITY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

CARBOXYLIC ACIDS;

AROMATIC SUBSTRATES; CATALYTIC MECHANISMS; CATALYTIC ROLE; CRYSTAL WATER MOLECULES; ENZYMATIC REACTION; HYDROXYPYRIDINE; OXYGENASES; PEPTIDE BONDS; REACTION BARRIERS; REACTION ENERGY; RING OPENING; SIDE CHAINS; SUCCINIC ACIDS; TRANSITION STATE;

HYDROXYLATION;

EID: 79951973966     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp111525p     Document Type: Article

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