Structure-Guided Synthesis of FK506 and FK520 Analogs with Increased Selectivity Exhibit In Vivo Therapeutic Efficacy against Cryptococcus.
PMID:35604094
Design of protein-binding proteins from the target structure alone.
PMID:35332283
Identification of fragments binding to SARS-CoV-2 nsp10 reveals ligand-binding sites in conserved interfaces between nsp10 and nsp14/nsp16.
PMID:35128408
Determining the oxidation state of elements by X-ray crystallography.
PMID:35102889
Detecting ice artefacts in processed macromolecular diffraction data with machine learning.
PMID:35102884
Structures of plasmepsin X from Plasmodium falciparum reveal a novel inactivation mechanism of the zymogen and molecular basis for binding of inhibitors in mature enzyme.
PMID:35048450
Worldwide Protein Data Bank (wwPDB): A virtual treasure for research in biotechnology.
PMID:34908533
Optimal structure determination from sub-optimal diffraction data.
PMID:34783106
Detecting anomalies in X-ray diffraction images using convolutional neural networks.
PMID:34366575
Likelihood-based estimation of substructure content from single-wavelength anomalous diffraction (SAD) intensity data.
PMID:34196615
Crystal structure of Z-DNA in complex with the polyamine putrescine and potassium cations at ultra-high resolution.
PMID:34096514
FragMAXapp: crystallographic fragment-screening data-analysis and project-management system.
PMID:34076593
A trimethoprim derivative impedes antibiotic resistance evolution.
PMID:34011959
Making the invisible enemy visible.
PMID:33972785
Structural genomics and the Protein Data Bank.
PMID:33957120
Rapid response to emerging biomedical challenges and threats.
PMID:33953926
Gcn5-Related N-Acetyltransferases (GNATs) With a Catalytic Serine Residue Can Play Ping-Pong Too.
PMID:33912589
Structural analysis of new compound heterozygous variants in PEPD gene identified in a patient with Prolidase Deficiency diagnosed by exome sequencing.
PMID:33877262
Ice in biomolecular cryocrystallography.
PMID:33825714
Crystal structure of timothy grass allergen Phl p 12.0101 reveals an unusual profilin dimer.
PMID:33720678
Crystal structure of acetoacetyl-CoA reductase from Rickettsia felis.
PMID:33620038
Synchrotron Radiation as a Tool for Macromolecular X-Ray Crystallography: a XXI Century Perspective.
PMID:33603257
Hydroxylation of Antitubercular Drug Candidate, SQ109, by Mycobacterial Cytochrome P450.
PMID:33081390
Molecular determinants of vascular transport of dexamethasone in COVID-19 therapy.
PMID:33063792
Covid-19.bioreproducibility.org: A web resource for SARS-CoV-2-related structural models.
PMID:32981130
Structure of the Complex of an Iminopyridinedione Protein Tyrosine Phosphatase 4A3 Phosphatase Inhibitor with Human Serum Albumin.
PMID:32978326
Molecular determinants of vascular transport of dexamethasone in COVID-19 therapy.
PMID:32743572
Albumin-Based Transport of Nonsteroidal Anti-Inflammatory Drugs in Mammalian Blood Plasma.
PMID:32469516
Ligand-centered assessment of SARS-CoV-2 drug target models in the Protein Data Bank.
PMID:32418327
Comparison of metal-bound and unbound structures of aminopeptidase B proteins from Escherichia coli and Yersinia pestis.
PMID:32306515
Structures of glyceraldehyde 3-phosphate dehydrogenase in Neisseria gonorrhoeae and Chlamydia trachomatis.
PMID:31930578
Structure of HhaI endonuclease with cognate DNA at an atomic resolution of 1.0 Å.
PMID:31879785
Non-merohedral twinning: from minerals to proteins.
PMID:31793898
The Integrated Resource for Reproducibility in Macromolecular Crystallography: Experiences of the first four years.
PMID:31768399
Structural and biochemical analysis of Bacillus anthracis prephenate dehydrogenase reveals an unusual mode of inhibition by tyrosine via the ACT domain.
PMID:31750992
PDBe: improved findability of macromolecular structure data in the PDB.
PMID:31691821
FACT and FAIR with Big Data allows objectivity in science: The view of crystallography.
PMID:31673568
Findable Accessible Interoperable Re-usable (FAIR) diffraction data are coming to protein crystallography.
PMID:31236090
Pyrimidine biosynthesis in pathogens - Structures and analysis of dihydroorotases from Yersinia pestis and Vibrio cholerae.
PMID:31207330
Findable Accessible Interoperable Re-usable (FAIR) diffraction data are coming to protein crystallography.
PMID:31098014
Findable Accessible Interoperable Re-usable (FAIR) diffraction data are coming to protein crystallography.
PMID:31063147
Findable Accessible Interoperable Re-usable (FAIR) diffraction data are coming to protein crystallography.
PMID:31045560
Crystal structure and activity-based labeling reveal the mechanisms for linkage-specific substrate recognition by deubiquitinase USP9X.
PMID:30914461
Testosterone meets albumin - the molecular mechanism of sex hormone transport by serum albumins.
PMID:30842823
Challenge data set for macromolecular multi-microcrystallography.
PMID:30821701
Never too late for endothelin.
PMID:30605124
A Gcn5-Related N-Acetyltransferase (GNAT) Capable of Acetylating Polymyxin B and Colistin Antibiotics in Vitro.
PMID:30499668
A close look onto structural models and primary ligands of metallo-β-lactamases.
PMID:30466711
Refining the macromolecular model - achieving the best agreement with the data from X-ray diffraction experiment.
PMID:30416256
Nucleobase carbonyl groups are poor Mg2+ inner-sphere binders but excellent monovalent ion binders-a critical PDB survey.
PMID:30409785
Protein Data Bank: the single global archive for 3D macromolecular structure data.
PMID:30357364
Ab initio structure solution of a proteolytic fragment using ARCIMBOLDO.
PMID:30198884
Differences in substrate specificity of V. cholerae FabH enzymes suggest new approaches for the development of novel antibiotics and biofuels.
PMID:29917313
Structural biology data archiving - where we are and what lies ahead.
PMID:29749603
Structural, Biochemical, and Evolutionary Characterizations of Glyoxylate/Hydroxypyruvate Reductases Show Their Division into Two Distinct Subfamilies.
PMID:29309127
DA+ data acquisition and analysis software at the Swiss Light Source macromolecular crystallography beamlines.
PMID:29271779
Online tools for enhancing presentation, understanding, and retention of 3D structural data.
PMID:29205914
Validation of Structures in the Protein Data Bank.
PMID:29174494
PDBe: towards reusable data delivery infrastructure at protein data bank in Europe.
PMID:29126160
The science is in the data.
PMID:29123672
Detect, correct, retract: How to manage incorrect structural models.
PMID:29113027
Molstack-Interactive visualization tool for presentation, interpretation, and validation of macromolecules and electron density maps.
PMID:28815771
Raw diffraction data preservation and reuse: overview, update on practicalities and metadata requirements.
PMID:28250944
Sharing Big Data.
PMID:28250936
The crystal structure of dihydrodipicolinate reductase from the human-pathogenic bacterium Bartonella henselae strain Houston-1 at 2.3 Å resolution.
PMID:27917836