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Quantum chemical modeling of the reaction path of chorismate mutase based on the experimental substrate/product complex

Chorismate mutase is a well‐known model enzyme, catalyzing the Claisen rearrangement of chorismate to prephenate. Recent high‐resolution crystal structures along the reaction coordinate of this enzyme enabled computational analyses at unprecedented detail. Using quantum chemical simulations, we inve...

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Shranjeno v:
Bibliografske podrobnosti
izdano v:FEBS Open Bio
Main Authors: Burschowsky, Daniel, Krengel, Ute, Uggerud, Einar, Balcells, David
Format: Artigo
Jezik:Inglês
Izdano: John Wiley and Sons Inc. 2017
Teme:
Online dostop:https://ncbi.nlm.nih.gov/pmc/articles/PMC5458464/
https://ncbi.nlm.nih.gov/pubmed/28593134
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/2211-5463.12224
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