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Transition state structures and intermediates modeling carboxylation reactions catalyzed by rubisco. a quantum chemical study of the role of magnesium and its coordination sphere
Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Chemistry, Department of Physical Chemistry.
2001 (English)In: JOURNAL OF PHYSICAL CHEMISTRY A, ISSN 1089-5639, Vol. 105, no 40, 9243-9251 Language: English p.Article in journal (Refereed) Published
Abstract [en]

The reactive sequences mimicking the carboxylation chemistry catalyzed by Rubisco are characterized at HF/3-21G and HF/6-31G** calculation levels. Hydroxypropanone, (CH3)-H-1-(CO)-O-2-(CH2OH)-H-3, represents the substrate D-ribulose-1,5-bisphosphate, whil

Place, publisher, year, edition, pages
AMER CHEMICAL SOC , 2001. Vol. 105, no 40, 9243-9251 Language: English p.
Keyword [en]
RIBULOSE-1;5-BISPHOSPHATE CARBOXYLASE; RIBULOSE 1;5-BISPHOSPHATE; MOLECULAR MECHANISM; OXYGENATION; SUBSTRATE; CHEMISTRY; INVERSION; SYSTEM; BOND
Identifiers
URN: urn:nbn:se:uu:diva-37258OAI: oai:DiVA.org:uu-37258DiVA: diva2:65157
Note
Addresses: Safont VS, Univ Jaume 1, Dept Ciencies Expt, Box 224, Castello 12080, Spain. Univ Jaume 1, Dept Ciencies Expt, Castello 12080, Spain. Univ Uppsala, Dept Phys Chem, S-75121 Uppsala, Sweden.Available from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-14

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