| Literature DB >> 26456543 |
L Muñoz-Rugeles1, J R Alvarez-Idaboy1.
Abstract
Density functional theory calculations, using the SMD continuum model, indicate that hydrogen transfer from totally protonated uric to a tryptophanyl radical in proteins corresponds to a sequential mechanism. Modeling in methyl butanoate indicates that this mechanism is more important in a hydrophobic medium than in water.Entities:
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Year: 2015 PMID: 26456543 DOI: 10.1039/c5cp05090a
Source DB: PubMed Journal: Phys Chem Chem Phys ISSN: 1463-9076 Impact factor: 3.676