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Selective prediction of interaction sites in protein structures with THEMATICS

✍ Scribed by Ying Wei; Jaeju Ko; Leonel F Murga; Mary Jo Ondrechen


Book ID
115000731
Publisher
BioMed Central
Year
2007
Tongue
English
Weight
769 KB
Volume
8
Category
Article
ISSN
1471-2105

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Biomolecular associations are governed by energetics that influence the stable or the transient nature of various bindings. Ab initio MO calculations on model systems representing a metal ion-carboxylate-water triad in proteins have been performed. Depending on the structural or catalytic role of th