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Chemistry - A European Journal

Volumn 19, Issue 2, 2013, Pages 771-781

On the catalytic mechanism of (S)-2-hydroxypropylphosphonic acid epoxidase (HppE): A hybrid DFT study

(3) Miłaczewska, Anna a Broclawik, Ewa a Borowski, Tomasz a

a INSTITUTE OF CATALYSIS AND SURFACE CHEMISTRY (Poland)

Author keywords

antibiotics; biosynthesis; density functional calculations; epoxidation; iron

Indexed keywords

ACTIVE SITE; BARRIER HEIGHTS; CATALYTIC MECHANISMS; CH-BOND ACTIVATION; FOSFOMYCIN; HYBRID DFT; PLAUSIBLE MECHANISMS; POLAR GROUPS; REACTION ENERGY; RING CLOSURES;

ANTIBIOTICS; BIOCHEMISTRY; BIOSYNTHESIS; DENSITY FUNCTIONAL THEORY; EPOXIDATION; HYDROXYLATION; IRON; IRON COMPOUNDS; LIGANDS; QUANTUM CHEMISTRY;

SUBSTRATES;

2 HYDROXYPROPYLPHOSPHONIC ACID; 2 HYDROXYPROPYLPHOSPHONIC ACID EPOXIDASE; 2-HYDROXYPROPYLPHOSPHONIC ACID; 2-HYDROXYPROPYLPHOSPHONIC ACID EPOXIDASE; OXIDOREDUCTASE; PHOSPHONIC ACID DERIVATIVE;

ARTICLE; BIOCATALYSIS; CHEMICAL STRUCTURE; CHEMISTRY; ENZYME ACTIVE SITE; METABOLISM; OXIDATION REDUCTION REACTION; QUANTUM THEORY; THERMODYNAMICS;

BIOCATALYSIS; CATALYTIC DOMAIN; MODELS, MOLECULAR; ORGANOPHOSPHONATES; OXIDATION-REDUCTION; OXIDOREDUCTASES; QUANTUM THEORY; THERMODYNAMICS;

EID: 84871952360 PISSN: 09476539 EISSN: 15213765 Source Type: Journal
DOI: 10.1002/chem.201202825 Document Type: Article

Times cited : (22)

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