Solid-state NMR: Methods for biological solids

S Ahlawat, KR Mote, NA Lakomek… - Chemical Reviews, 2022 - ACS Publications
In the last two decades, solid-state nuclear magnetic resonance (ssNMR) spectroscopy has
transformed from a spectroscopic technique investigating small molecules and industrial …

First-principles calculation of NMR parameters using the gauge including projector augmented wave method: a chemist's point of view

C Bonhomme, C Gervais, F Babonneau… - Chemical …, 2012 - ACS Publications
First-principles calculations of NMR parameters in solids (including the chemical shift, the
quadrupolar interaction for nuclei with spin quantum number I> 1/2, and the indirect J …

Proton detected solid-state NMR of membrane proteins at 28 Tesla (1.2 GHz) and 100 kHz magic-angle spinning

E Nimerovsky, KT Movellan, XC Zhang, MC Forster… - Biomolecules, 2021 - mdpi.com
The available magnetic field strength for high resolution NMR in persistent superconducting
magnets has recently improved from 23.5 to 28 Tesla, increasing the proton resonance …

Dipolar truncation in magic-angle spinning NMR recoupling experiments

MJ Bayro, M Huber, R Ramachandran… - The Journal of …, 2009 - pubs.aip.org
Quantitative solid-state NMR distance measurements in strongly coupled spin systems are
often complicated due to the simultaneous presence of multiple noncommuting spin …

Quantifying weak hydrogen bonding in uracil and 4-Cyano-4 '-ethynylbiphenyl: a combined computational and experimental investigation of NMR chemical shifts in …

AC Uldry, JM Griffin, JR Yates… - Journal of the …, 2008 - ACS Publications
Weak hydrogen bonding in uracil and 4-cyano-4 '-ethynylbiphenyl, for which single-crystal
diffraction structures reveal close CH⊙⊙⊙ OC and C⋮ CH⊙⊙⊙ N⋮ C distances, is …

High-Resolution 19F MAS NMR Spectroscopy: Structural Disorder and Unusual J Couplings in a Fluorinated Hydroxy-Silicate

JM Griffin, JR Yates, AJ Berry, S Wimperis… - Journal of the …, 2010 - ACS Publications
High-resolution 19F magic angle spinning (MAS) NMR spectroscopy is used to study
disorder and bonding in a crystalline solid. 19F MAS NMR reveals four distinct F sites in a …

A general protocol for determining the structures of molecularly ordered but noncrystalline silicate frameworks

DH Brouwer, S Cadars, J Eckert, Z Liu… - Journal of the …, 2013 - ACS Publications
A general protocol is demonstrated for determining the structures of molecularly ordered but
noncrystalline solids, which combines constraints provided by X-ray diffraction (XRD), one …

Robust NMR approaches for the determination of homonuclear dipole–dipole coupling constants in studies of solid materials and biomolecules

K Saalwächter - ChemPhysChem, 2013 - Wiley Online Library
This review addresses the NMR spectroscopy study of molecular structure and dynamics by
way of homonuclear dipole–dipole couplings by relying on their orientation and direct …

Weak Intermolecular CH···N Hydrogen Bonding: Determination of 13CH–15N Hydrogen-Bond Mediated J Couplings by Solid-State NMR Spectroscopy and First …

AL Webber, JR Yates, M Zilka, S Sturniolo… - The Journal of …, 2019 - ACS Publications
Weak hydrogen bonds are increasingly hypothesized to play key roles in a wide range of
chemistry from catalysis to gelation to polymer structure. Here, 15N/13C spin-echo magic …

Ultrafast magic angle spinning nuclear magnetic resonance

M Deschamps - Annual reports on NMR spectroscopy, 2014 - Elsevier
Recent advances in magic angle spinning (MAS) now allow spinning frequencies of 40 to
110 kHz to be reached. Ultrafast MAS is achieved in rotors with diameters smaller than …