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[HTML][HTML] Paramagnetic NMR in solution and the solid state
The field of paramagnetic NMR has expanded considerably in recent years. This review
addresses both the theoretical description of paramagnetic NMR, and the way in which it is …
addresses both the theoretical description of paramagnetic NMR, and the way in which it is …
Paramagnetic chemical probes for studying biological macromolecules
Paramagnetic chemical probes have been used in electron paramagnetic resonance (EPR)
and nuclear magnetic resonance (NMR) spectroscopy for more than four decades. Recent …
and nuclear magnetic resonance (NMR) spectroscopy for more than four decades. Recent …
Develo** a molecular dynamics force field for both folded and disordered protein states
Molecular dynamics (MD) simulation is a valuable tool for characterizing the structural
dynamics of folded proteins and should be similarly applicable to disordered proteins and …
dynamics of folded proteins and should be similarly applicable to disordered proteins and …
Structure determination of high-energy states in a dynamic protein ensemble
JB Stiller, R Otten, D Häussinger, PS Rieder… - Nature, 2022 - nature.com
Macromolecular function frequently requires that proteins change conformation into high-
energy states,,–. However, methods for solving the structures of these functionally essential …
energy states,,–. However, methods for solving the structures of these functionally essential …
Structural characterization of flexible proteins using small-angle X-ray scattering
Structural analysis of flexible macromolecular systems such as intrinsically disordered or
multidomain proteins with flexible linkers is a difficult task as high-resolution techniques are …
multidomain proteins with flexible linkers is a difficult task as high-resolution techniques are …
Theory, practice, and applications of paramagnetic relaxation enhancement for the characterization of transient low-population states of biological macromolecules …
Understanding the function of biological macromolecules and their complexes at the
physicochemical level requires knowledge of both their structure and dynamics …
physicochemical level requires knowledge of both their structure and dynamics …
Perspectives on NMR in drug discovery: a technique comes of age
In the past decade, the potential of harnessing the ability of nuclear magnetic resonance
(NMR) spectroscopy to monitor intermolecular interactions as a tool for drug discovery has …
(NMR) spectroscopy to monitor intermolecular interactions as a tool for drug discovery has …
Protein NMR using paramagnetic ions
G Otting - Annual review of biophysics, 2010 - annualreviews.org
Paramagnetic metal ions offer outstanding opportunities for protein studies by nuclear
magnetic resonance (NMR) spectroscopy. The paramagnetic effects manifested in the NMR …
magnetic resonance (NMR) spectroscopy. The paramagnetic effects manifested in the NMR …
Pseudocontact shifts in biomolecular NMR spectroscopy
T Müntener, D Joss, D Häussinger… - Chemical Reviews, 2022 - ACS Publications
Paramagnetic centers in biomolecules, such as specific metal ions that are bound to a
protein, affect the nuclei in their surrounding in various ways. One of these effects is the …
protein, affect the nuclei in their surrounding in various ways. One of these effects is the …
NMR spectroscopy of paramagnetic metalloproteins
This article deals with the solution structure determination of paramagnetic metalloproteins
by NMR spectroscopy. These proteins were believed not to be suitable for NMR …
by NMR spectroscopy. These proteins were believed not to be suitable for NMR …