Premium
NMR‐Guided Fragment‐Based Approach for the Design of AAC(6′)‐Ib Ligands
Author(s) -
Lombès Thomas,
Bégis Guillaume,
Maurice Frédérique,
Turcaud Serge,
Lecourt Thomas,
Dardel Frédéric,
Micouin Laurent
Publication year - 2008
Publication title -
chembiochem
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.05
H-Index - 126
eISSN - 1439-7633
pISSN - 1439-4227
DOI - 10.1002/cbic.200700677
Subject(s) - fragment (logic) , ligand (biochemistry) , chemistry , combinatorial chemistry , stereochemistry , enzyme , biochemistry , computer science , receptor , algorithm
Reverse n.O.e. pumping in the detection and optimisation of ligands : Ligand‐observed NMR experiments have been used to drive the detection and optimisation of non‐aminoglycosidic ligands for AAC(6′)Ib, one of the most clinically important resistance enzymes to aminoglycosides. This fragment‐based approach has been conducted without any need for NMR structural assignment of the target, and has been validated by the preparation of a bisubstrate inhibitor.