Principles for integrative structural biology studies
Integrative structure determination is a powerful approach to modeling the structures of
biological systems based on data produced by multiple experimental and theoretical …
biological systems based on data produced by multiple experimental and theoretical …
Structural characterization of proteins and complexes using small-angle X-ray solution scattering
HDT Mertens, DI Svergun - Journal of structural biology, 2010 - Elsevier
Small-angle scattering of X-rays (SAXS) is an established method for the low-resolution
structural characterization of biological macromolecules in solution. The technique provides …
structural characterization of biological macromolecules in solution. The technique provides …
TALOS+: a hybrid method for predicting protein backbone torsion angles from NMR chemical shifts
NMR chemical shifts in proteins depend strongly on local structure. The program TALOS
establishes an empirical relation between 13 C, 15 N and 1 H chemical shifts and backbone …
establishes an empirical relation between 13 C, 15 N and 1 H chemical shifts and backbone …
[PDF][PDF] 2017 publication guidelines for structural modelling of small-angle scattering data from biomolecules in solution: an update
In 2012, preliminary guidelines were published addressing sample quality, data acquisition
and reduction, presentation of scattering data and validation, and modelling for biomolecular …
and reduction, presentation of scattering data and validation, and modelling for biomolecular …
Evolving SAXS versatility: solution X-ray scattering for macromolecular architecture, functional landscapes, and integrative structural biology
CA Brosey, JA Tainer - Current opinion in structural biology, 2019 - Elsevier
Highlights•SAXS captures architecture and dynamics to elucidate molecular
ensembles.•SAXS advances now probe key thermodynamic and kinetic properties of …
ensembles.•SAXS advances now probe key thermodynamic and kinetic properties of …
Small‐angle scattering for structural biology—Expanding the frontier while avoiding the pitfalls
The last decade has seen a dramatic increase in the use of small‐angle scattering for the
study of biological macromolecules in solution. The drive for more complete structural …
study of biological macromolecules in solution. The drive for more complete structural …
[HTML][HTML] Methyl TROSY spectroscopy: a versatile NMR approach to study challenging biological systems
S Schütz, R Sprangers - Progress in nuclear magnetic resonance …, 2020 - Elsevier
A major goal in structural biology is to unravel how molecular machines function in detail. To
that end, solution-state NMR spectroscopy is ideally suited as it is able to study biological …
that end, solution-state NMR spectroscopy is ideally suited as it is able to study biological …
SAXS ensemble refinement of ESCRT-III CHMP3 conformational transitions
We developed and implemented an ensemble-refinement method to study dynamic
biomolecular assemblies with intrinsically disordered segments. Data from small angle X-ray …
biomolecular assemblies with intrinsically disordered segments. Data from small angle X-ray …
Critical assessment of methods of protein structure prediction: Progress and new directions in round XI
Modeling of protein structure from amino acid sequence now plays a major role in structural
biology. Here we report new developments and progress from the CASP11 community …
biology. Here we report new developments and progress from the CASP11 community …
Target flexibility: an emerging consideration in drug discovery and design
Structure-based drug discovery has played an important role in medicinal chemistry, 1
beginning nearly when the first X-ray crystal structure of the myoglobin and hemoglobin …
beginning nearly when the first X-ray crystal structure of the myoglobin and hemoglobin …