DIALS as a toolkit

G Winter, J Beilsten‐Edmands, N Devenish… - Protein …, 2022 - Wiley Online Library
The DIALS software for the processing of X‐ray diffraction data is presented, with an
emphasis on how the suite may be used as a toolkit for data processing. The description …

Comprehensive microcrystal electron diffraction sample preparation for cryo-EM

WJ Nicolas, C Gillman, SJ Weaver, MTB Clabbers… - Nature …, 2024 - nature.com
Microcrystal electron diffraction (MicroED) has advanced structural methods across a range
of sample types, from small molecules to proteins. This cryogenic electron microscopy (cryo …

[PDF][PDF] Metalloprotein catalysis: Structural and mechanistic insights into oxidoreductases from neutron protein crystallography

GC Schröder, F Meilleur - Acta Crystallographica Section D …, 2021 - journals.iucr.org
Metalloproteins catalyze a range of reactions, with enhanced chemical functionality due to
their metal cofactor. The reaction mechanisms of metalloproteins have been experimentally …

Protein lipidation types: current strategies for enrichment and characterization

R Wang, YQ Chen - International Journal of Molecular Sciences, 2022 - mdpi.com
Post-translational modifications regulate diverse activities of a colossal number of proteins.
For example, various types of lipids can be covalently linked to proteins enzymatically or non …

[HTML][HTML] Microcrystal electron diffraction structure of Toll-like receptor 2 TIR-domain-nucleated MyD88 TIR-domain higher-order assembly

Y Li, LC Pacoste, W Gu, SJ Thygesen… - Biological …, 2024 - journals.iucr.org
Eukaryotic TIR (Toll/interleukin-1 receptor protein) domains signal via TIR–TIR interactions,
either by self-association or by interaction with other TIR domains. In mammals, TIR domains …

MicroED for the study of protein–ligand interactions and the potential for drug discovery

LJ Clark, G Bu, BL Nannenga, T Gonen - Nature Reviews Chemistry, 2021 - nature.com
Microcrystal electron diffraction (MicroED) is an electron cryo-microscopy (cryo-EM)
technique used to determine molecular structures with crystals that are a millionth the size …

Structure determination of a DNA crystal by MicroED

A Haymaker, AA Bardin, T Gonen, MW Martynowycz… - Structure, 2023 - cell.com
Microcrystal electron diffraction (MicroED) is a powerful tool for determining high-resolution
structures of microcrystals from a diverse array of biomolecular, chemical, and material …

On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors

L Pacoste, VM Ignat'ev, PM Dominiak, X Zou - IUCrJ, 2024 - journals.iucr.org
This study examines various methods for modelling the electron density and, thus, the
electrostatic potential of an organometallic complex for use in crystal structure refinement …

How to use DIALS to process chemical crystallography 3D ED rotation data from pixel array detectors

A Vypritskaia, X Zou, T Yang… - Crystal Structure …, 2025 - journals.iucr.org
The DIALS package provides a set of tools for crystallographic data processing. The open-
source nature of the project, and a flexible interface in which individual command-line …

Low-Dose Electron Crystallography: Structure Solution and Refinement

H Klein, S Kodjikian, E Yörük, P Bordet - Symmetry, 2022 - mdpi.com
There is a wealth of materials that are beam sensitive and only exist in nanometric crystals,
because the growth of bigger crystals is either impossible or so complicated that it is not …