The Phenix software for automated determination of macromolecular structures

PD Adams, PV Afonine, G Bunkóczi, VB Chen… - Methods, 2011 - Elsevier
X-ray crystallography is a critical tool in the study of biological systems. It is able to provide
information that has been a prerequisite to understanding the fundamentals of life. It is also a …

[PDF][PDF] The PDB_REDO server for macromolecular structure model optimization

RP Joosten, F Long, GN Murshudov, A Perrakis - IUCrJ, 2014 - journals.iucr.org
The refinement and validation of a crystallographic structure model is the last step before the
coordinates and the associated data are submitted to the Protein Data Bank (PDB). The …

Degradation of complex arabinoxylans by human colonic Bacteroidetes

GV Pereira, AM Abdel-Hamid, S Dutta… - Nature …, 2021 - nature.com
Some Bacteroidetes and other human colonic bacteria can degrade arabinoxylans, common
polysaccharides found in dietary fiber. Previous work has identified gene clusters …

[PDF][PDF] Phaser crystallographic software

AJ McCoy, RW Grosse-Kunstleve… - Journal of applied …, 2007 - journals.iucr.org
Phaser is a program for phasing macromolecular crystal structures by both molecular
replacement and experimental phasing methods. The novel phasing algorithms …

[PDF][PDF] Overview of the CCP4 suite and current developments

MD Winn, CC Ballard, KD Cowtan… - … Section D: Biological …, 2011 - journals.iucr.org
The CCP4 (Collaborative Computational Project, Number 4) software suite is a collection of
programs and associated data and software libraries which can be used for macromolecular …

[PDF][PDF] Molecular replacement then and now

G Scapin - Acta Crystallographica Section D: Biological …, 2013 - journals.iucr.org
Thephase problem'in crystallography results from the inability to directly measure the
phases of individual diffracted X-ray waves. While intensities are directly measured during …

MyD88 TIR domain higher-order assembly interactions revealed by microcrystal electron diffraction and serial femtosecond crystallography

MTB Clabbers, S Holmes, TW Muusse… - Nature …, 2021 - nature.com
MyD88 and MAL are Toll-like receptor (TLR) adaptors that signal to induce pro-inflammatory
cytokine production. We previously observed that the TIR domain of MAL (MALTIR) forms …

CHAINSAW: a program for mutating pdb files used as templates in molecular replacement

N Stein - Journal of applied crystallography, 2008 - journals.iucr.org
CHAINSAW is a model editing program for use in molecular replacement. Given a sequence
alignment between template and target, it modifies the template structure on a residue-by …

Complex N-glycan breakdown by gut Bacteroides involves an extensive enzymatic apparatus encoded by multiple co-regulated genetic loci

J Briliūtė, PA Urbanowicz, AS Luis, A Baslé… - Nature …, 2019 - nature.com
Glycans are the major carbon sources available to the human colonic microbiota. Numerous
N-glycosylated proteins are found in the human gut, from both dietary and host sources …

Structure of a bacterial voltage-gated sodium channel pore reveals mechanisms of opening and closing

EC McCusker, C Bagnéris, CE Naylor, AR Cole… - Nature …, 2012 - nature.com
Voltage-gated sodium channels are vital membrane proteins essential for electrical
signalling; in humans, they are key targets for the development of pharmaceutical drugs …