Table of Contents
Magnetochemistry, Volume 4, Issue 1 (March 2018)
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Cover Story (view full-size image) NMR2(NMR Molecular Replacement) is an MR-like approach in NMR to determine the structures of the [...] Read more. NMR2(NMR Molecular Replacement) is an MR-like approach in NMR to determine the structures of the binding pockets of ligands at atomic resolution. It is fast, since it requires only a few days of measuring time and circumvents the time-consuming sequential assignment steps for the protein. NMR2 yielded the structures of ligand–protein complexes with an accuracy below 1 Ångstrom for the binding pocket, irrespective of the initial protein structure templates used. Our findings demonstrate that NMR2 may open an avenue for fast and robust determination of the binding pocket structure of ligand–protein complexes at atomic resolution. View this paper