Chargement en cours...

Conformational Itinerary of Sucrose During Hydrolysis by Retaining Amylosucrase

By means of QM(DFT)/MM metadynamics we have unraveled the hydrolytic reaction mechanism of Neisseria polysaccharea amylosucrase (NpAS), a member of GH13 family. Our results provide an atomistic picture of the active site reorganization along the catalytic double-displacement reaction, clarifying whe...

Description complète

Enregistré dans:
Détails bibliographiques
Publié dans:Front Chem
Auteurs principaux: Alonso-Gil, Santiago, Coines, Joan, André, Isabelle, Rovira, Carme
Format: Artigo
Langue:Inglês
Publié: Frontiers Media S.A. 2019
Sujets:
Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC6502901/
https://ncbi.nlm.nih.gov/pubmed/31114783
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fchem.2019.00269
Tags: Ajouter un tag
Pas de tags, Soyez le premier à ajouter un tag!