Prediction of a ligand-binding niche within a human olfactory receptor by combining site-directed mutagenesis with dynamic homology modeling

Angewandte Chemie - International Edition

Volumn 51, Issue 5, 2012, Pages 1274-1278

  Gelis, Lian ^a   Wolf, Steffen ^b   Hatt, Hanns ^a   Neuhaus, Eva M ^c   Gerwert, Klaus ^a  

^a RUHR UNIVERSITY BOCHUM   (Germany)

^b MAX PLANCK INSTITUTE   (Germany)

^c CHARITÉ UNIVERSITÄTSMEDIZIN BERLIN   (Germany)

Author keywords

fragrances; functional characterization; molecular dynamics; molecular modeling; receptors

Indexed keywords

ACTIVATION PROPERTY; FUNCTIONAL CHARACTERIZATION; HOMOLOGY MODELING; LIGAND BINDING; OLFACTORY RECEPTORS; RECEPTOR MUTANTS; RECEPTORS; SITE DIRECTED MUTAGENESIS; THREE-DIMENSIONAL MODEL;

FRAGRANCES; LIGANDS; MOLECULAR DYNAMICS; MOLECULAR MODELING;

THREE DIMENSIONAL;

LIGAND; OR2AG1 PROTEIN, HUMAN;

ARTICLE; BINDING SITE; CHEMICAL STRUCTURE; CHEMISTRY; GENETICS; HUMAN; MOLECULAR DYNAMICS; OLFACTORY RECEPTOR; PROTEIN BINDING; SITE DIRECTED MUTAGENESIS; STRUCTURAL HOMOLOGY; STRUCTURE ACTIVITY RELATION;

BINDING SITES; HUMANS; LIGANDS; MODELS, MOLECULAR; MOLECULAR DYNAMICS SIMULATION; MUTAGENESIS, SITE-DIRECTED; PROTEIN BINDING; RECEPTORS, ODORANT; STRUCTURAL HOMOLOGY, PROTEIN; STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 84856156564     PISSN: 14337851     EISSN: 15213773     Source Type: Journal    
DOI: 10.1002/anie.201103980     Document Type: Article

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