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Charlène Esmieu, Dr. Mickaël V. Cherrier, Dr. Patricia Amara, Dr. Elodie Girgenti, Dr. Caroline Marchi-Delapierre, Dr. Frédéric Oddon, Marina Iannello, Adeline Jorge-Robin, Dr. Christine Cavazza and Dr. Stéphane Ménage An Artificial Oxygenase Built from Scratch: Substrate Binding Site Identified Using a Docking Approach Angewandte Chemie International Edition 52

Article first published online: 25 FEB 2013 | DOI: 10.1002/anie.201209021

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The substrate for an artificial iron monooxygenase was selected by using docking calculations. The high catalytic efficiency of the reported enzyme for sulfide oxidation was directly correlated to the predicted substrate binding mode in the protein cavity, thus illustrating the synergetic effect of the substrate binding site, protein scaffold, and catalytic site.

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