Naslov
Theoretical Studies of Coenzyme B12-Dependent Reactions: Recent Developments

Autori
Smith, David M.

Vrsta, podvrsta i kategorija rada
Sažeci sa skupova, sažetak, znanstveni

Izvornik
The 1st Split Meeting on Development and Applications of Novel Methods and Models in Computational Biophysics and Structural Bioinformatics / - , 2007

Skup
The 1st Split Meeting on Development and Applications of Novel Methods and Models in Computational Biophysics and Structural Bioinformatics

Mjesto i datum
Split, Hrvatska, 19.12.2007. - 21.12.2007

Vrsta sudjelovanja
Pozvano predavanje

Vrsta recenzije
Nije recenziran

Ključne riječi
coenzyme B12; ab initio; ESR

Sažetak
Coenzyme B12 is one of nature’ s most remarkable cofactors. It is involved in the catalysis of a wide variety of reactions essential for life in both prokaryotic and eukaryotic organisms. Without exception, the mechanisms of these reactions involve highly reactive organic free radicals. For this reason, the reactions, and particularly the relevant intermediates, are difficult to study experimentally. It is precisely in such a situation where a theoretical approach can provide important complimentary information. In this contribution, selected results of such investigations, obtained using small model systems, will be presented. Emphasis will be placed on the important link between radical stability and observability, particularly with respect to the link to electron spin resonance spectroscopy.

Izvorni jezik
Engleski

Znanstvena područja
Kemija

POVEZANOST RADA