Determining the Role of the Aromatic Ring of  N ‐Arylmethyl  ent ‐conduramine F‐1 in their Interactions with α‐Glucosidases by Saturation Transfer Difference NMR Spectroscopy Experiments | Zendy

Hernández Daranas Antonio | Zendy; Koteich Khatib Sonia | Zendy; Lysek Robert | Zendy; Vogel Pierre | Zendy; Gavín José A. | Zendy

Open Access

Determining the Role of the Aromatic Ring of N ‐Arylmethyl ent ‐conduramine F‐1 in their Interactions with α‐Glucosidases by Saturation Transfer Difference NMR Spectroscopy Experiments

Author(s) -

Hernández Daranas Antonio,

Koteich Khatib Sonia,

Lysek Robert,

Vogel Pierre,

Gavín José A.

Publication year - 2012

Publication title -

chemistryopen

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.644

H-Index - 29

ISSN - 2191-1363

DOI - 10.1002/open.201100004

Subject(s) - saturation (graph theory) , nuclear magnetic resonance spectroscopy , spectroscopy , chemistry , glucosidases , ring (chemistry) , stereochemistry , crystallography , physics , organic chemistry , mathematics , combinatorics , enzyme , quantum mechanics

Saturation transfer difference (STD) NMR spectroscopy was used to study the role of aromatic moieties in the inhibition of α‐glucosidases by N ‐arylmethyl ent ‐conduramine F‐1. STD epitope mapping and molecular docking simulations provide new insights into the structure‐based design of drugs targeting this enzyme (see figure).

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