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Transition structure and reactive complexes for hydride transfer in an isoalloxazine-nicotinamide complex. On the catalytic mechanism of glutathione reductase. An ab initio MO SCF study
Uppsala University.
Uppsala University.
Uppsala University.
Uppsala University.
1996 (English)In: CHEMICAL PHYSICS, Vol. 204, no 2-3, 195-203 p.Article in journal (Other scientific) Published
Abstract [en]

An analysis is presented of the catalytic mechanism of glutathione reductase based upon a theoretically characterized saddle point of index one obtained for a model representing the active groups of the flavine and nicotinamide adenine dinucleotide phosph

Place, publisher, year, edition, pages
ELSEVIER SCIENCE BV , 1996. Vol. 204, no 2-3, 195-203 p.
Keyword [en]
STATE THEORY; ENERGY HYPERSURFACES; COLLINEAR REACTIONS; HYDROGEN MOLECULES; DEHYDROGENASE; SYSTEMS; CATION
Identifiers
URN: urn:nbn:se:uu:diva-75057OAI: oai:DiVA.org:uu-75057DiVA: diva2:102967
Note
Addresses: UNIV UPPSALA, DEPT PHYS CHEM, S-75121 UPPSALA, SWEDEN. UNIV VALENCIA, DEPT QUIM FIS, E-46100 BURJASSOT, VALENCIA, SPAIN.Available from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-15

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