QM/MM Model of the Mouse Olfactory Receptor MOR244-3 Validated by Site-Directed Mutagenesis Experiments

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QM/MM model of the mouse olfactory receptor MOR244-3 validated by site-directed mutagenesis experiments.

Understanding structure/function relationships of olfactory receptors is challenging due to the lack of x-ray structural models. Here, we introduce a QM/MM model of the mouse olfactory receptor MOR244-3, responsive to organosulfur odorants such as (methylthio)methanethiol. The binding site consists of a copper ion bound to the heteroatoms of amino-acid residues H105, C109, and N202. The model i...

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ژورنال

عنوان ژورنال: Biophysical Journal

سال: 2014

ISSN: 0006-3495

DOI: 10.1016/j.bpj.2014.07.031