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Peroxynitrite-induced oxidation and nitration products of guanine and 8-oxoguanine: Structures and mechanisms of product formation

✍ Scribed by Jacquin C. Niles; John S. Wishnok; Steven R. Tannenbaum


Book ID
116790007
Publisher
Elsevier Science
Year
2006
Tongue
English
Weight
357 KB
Volume
14
Category
Article
ISSN
1089-8603

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πŸ“œ SIMILAR VOLUMES


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✍ N. R. Jena; P. C. Mishra πŸ“‚ Article πŸ“… 2007 πŸ› John Wiley and Sons 🌐 English βš– 660 KB

## Abstract Reactions of peroxynitrite with guanine were investigated using density functional theory (B3LYP) employing 6‐31G\*\* and AUG‐cc‐pVDZ basis sets. Single point energy calculations were performed at the MP2/AUG‐cc‐pVDZ level. Genuineness of the calculated transition states (TS) was tested

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## Abstract The reaction between guanine radical cation (G^+Β·^) and carbonate radical anion (CO~3~**^βˆ’Β·^**) producing the mutagenic product 8‐oxoguanine that has been observed experimentally was investigated using density functional and second‐order MΓΈller–Plesset perturbation (MP2) theories. The s