Acta Crystallographica Section D-Structural Biology

Papers
(The TQCC of Acta Crystallographica Section D-Structural Biology is 8. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2021-12-01 to 2025-12-01.)
ArticleCitations
Using graphlet degree vectors to predict atomic displacement parameters in protein structures667
Structure of the Fab fragment of a humanized 5E5 antibody to a cancer-specific Tn-MUC1 epitope90
EMhub: a web platform for data management and on-the-fly processing in scientific facilities69
Cryo-EM single-particle analysis expanding towards increasingly native samples63
Crystallographic fragment screening against SARS-CoV-2 nonstructural protein 1 using the F2X-Entry Screen and a newly developed fragment library62
Structural visualization of transient interactions between the cis-acting acyltransferase and acyl carrier protein of the salinomycin modular polyketide synthase59
Completion of partial structures using Patterson maps with the CrysFormer machine-learning model50
Limiting the effects of radiation damage in MicroED through dose selection during data processing47
Comparison of two crystal polymorphs of NowGFP reveals a new conformational state trapped by crystal packing45
Structural flexibility of Toscana virus nucleoprotein in the presence of a single-chain camelid antibody44
Updated restraint dictionaries for carbohydrates in the pyranose form39
Crystal structure of DNA polymerase I from Thermus phage G20c34
X-ray diffraction and in vivo studies reveal the quinary structure of Trypanosoma cruzi nucleoside diphosphate kinase 1: a novel helical oligomer structure33
Structures of α-galactosaminidases from the CAZy GH114 family and homologs defining a new GH191 family of glycosidases33
Data collection from crystals grown in microfluidic droplets30
A scalable strategy to solve structures of PDZ domains and their complexes25
Structures of permuted halves of a modern ribose-binding protein23
Identifying and avoiding radiation damage in macromolecular crystallography23
Critical evaluation of three cryo-EM structures of particulate methane monooxygenase by quantum refinement23
Structural studies of NAD + -dependent methanol dehydrogenase 1 from Bacillus methanolicus MGA322
On bias, variance, overfitting, gold standard and consensus in single-particle analysis by cryo-electron microscopy19
Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals19
The crystal structure of CbpD clarifies substrate-specificity motifs in chitin-active lytic polysaccharide monooxygenases18
The crystal structure of the N-terminal domain of the backbone pilin LrpA reveals a new closure-and-twist motion for assembling dynamic pili in Ligilactobacillus ruminis18
A radical approach to radicals18
Raw diffraction data are our ground truth from which all subsequent workflows develop18
Structural characterization of the ACDC domain from ApiAP2 proteins, a potential molecular target against apicomplexan parasites18
A recurring packing contact in crystals of InlB pinpoints functional binding sites in the internalin domain and the B repeat18
Training undergraduate research assistants with an outcome-oriented and skill-based mentoring strategy17
Biophysical Chemistry, Second Edition. By Dagmar Klostermeier and Markus G. Rudolph. CRC Press, Boca Raton, 2025, pp. 944. ISBN 9781032060835. Price GBP 57.39 (hardback)16
Analysis and validation of overall N-glycan conformation in Privateer16
Validation of helical symmetry parameters in the EMDB16
An alternative conformation of the N-terminal loop of human dihydroorotate dehydrogenase drives binding to a potent antiproliferative agent16
Overall protein structure quality assessment using hydrogen-bonding parameters16
Deciphering the crystal structure of a novel nanobody against the NEIL1 DNA glycosylase15
Statistical analyses of the oxidized P-clusters in MoFe proteins using the bond-valence method: towards their electron transfer in nitrogenases15
Crystal structure of coagulation factor XII N-terminal domains 1–515
Notes of a protein crystallographer: the advantages of combining new integrated methods of structure solution with traditional data visuals14
Structural and functional analysis of the D-alanyl carrier protein ligase DltA from Staphylococcus aureus Mu5014
Structural studies of β-glucosidase from the thermophilic bacterium Caldicellulosiruptor saccharolyticus14
Time-resolved serial femtosecond crystallography on fatty-acid photodecarboxylase: lessons learned14
3D structures of the Plasmodium vivax subtilisin-like drug target SUB1 reveal conformational changes to accommodate a substrate-derived α-ketoamide inhibitor14
Medical contrast agents as promising tools for biomacromolecular SAXS experiments14
A high-resolution data set of fatty acid-binding protein structures. III. Unexpectedly high occurrence of wrong ligands14
Alexei Vagin (1944–2023)13
Secret of Life: Rosalind Franklin, James Watson, Francis Crick, and the discovery of DNA's Double Helix. By Howard Markel. W. W. Norton & Co., 2021. Hardback, pp. 608. ISBN 978-1324002239. 13
The T2 structure of polycrystalline cubic human insulin13
Michael James (1940–2023)13
Pillar data-acquisition strategies for cryo-electron tomography of beam-sensitive biological samples13
Molecular basis of transcriptional repression of anti-CRISPR by anti-CRISPR-associated 212
Preparation and characterization of inactivated tick-borne encephalitis virus samples for single-particle imaging at the European XFEL12
Submission of structural biology data for review purposes12
Crystal structures of the molecular class A β-lactamase TEM-171 and its complexes with tazobactam12
Structural mechanism of Escherichia coli cyanase12
Fragment-based screening targeting an open form of the SARS-CoV-2 main protease binding pocket12
Knowledge-based prediction of DNA hydration using hydrated dinucleotides as building blocks11
Direct phasing algorithm for protein crystals with high solvent content using low-resolution diffraction data11
Comparative study of the effects of high hydrostatic pressure per se and high argon pressure on urate oxidase ligand stabilization11
A new inactive conformation of SARS-CoV-2 main protease11
Biochemical and structural insights into an unusual, alkali-metal-independent S-adenosyl-L-homocysteine hydrolase from Synechocystis sp. PCC 680311
The X-ray crystallography phase problem solved thanks to AlphaFold and RoseTTAFold models: a case-study report11
Best practices for time-resolved serial synchrotron crystallography11
Structural and functional characterization of a multi-domain GH92 α-1,2-mannosidase from Neobacillus novalis11
Probabilistic single-particle cryo-EM ab initio 3D reconstruction in SIMPLE11
Structural basis of the amidase ClbL central to the biosynthesis of the genotoxin colibactin11
Crystal structure of the monocupin ring-cleaving dioxygenase 5-nitrosalicylate 1,2-dioxygenase fromBradyrhizobiumsp.11
Cryo-EM reveals binding of linoleic acid to SARS-CoV-2 spike glycoprotein, suggesting an antiviral treatment strategy11
Elucidating polymorphs of crystal structures by intensity-based hierarchical clustering analysis of multiple diffraction data sets11
Raynals , an online tool for the analysis of dynamic light scattering10
Native glycosylation and binding of the antidepressant paroxetine in a low-resolution crystal structure of human myeloperoxidase10
Atomic resolution studies of S1 nuclease complexes reveal details of RNA interaction with the enzyme despite multiple lattice-translocation defects10
Dependence of crystallographic atomic displacement parameters on temperature (25–150 K) for complexes of horse liver alcohol dehydrogenase10
The LH–DH module of bacterial replicative helicases is the common binding site for DciA and other helicase loaders10
Atypical homodimerization revealed by the structure of the (S)-enantioselective haloalkane dehalogenase DmmarA from Mycobacterium marinum9
Correcting systematic errors in diffraction data with modern scaling algorithms9
Buccaneer model building with neural network fragment selection9
Glycoside hydrolase subfamily GH5_57 features a highly redesigned catalytic interface to process complex hetero-β-mannans9
Errors in structural biology are not the exception9
The High-Pressure Freezing Laboratory for Macromolecular Crystallography (HPMX), an ancillary tool for the macromolecular crystallography beamlines at the ESRF9
Tomo Live : an on-the-fly reconstruction pipeline to judge data quality for cryo-electron tomography workflows9
Structural insights into choline-O-sulfatase reveal the molecular determinants for ligand binding9
Structural basis for substrate recognition in the Phytolacca americana glycosyltransferase PaGT39
Structural and biophysical studies of new L-asparaginase variants: lessons from random mutagenesis of the prototypic Escherichia coli Ntn-amidohydrolase9
Restoration of the 3D structure of insect flight muscle from a rotationally averaged 2D X-ray diffraction pattern9
Polyelectrolyte coating of cryo-EM grids improves lateral distribution and prevents aggregation of macromolecules9
Accelerating crystal structure determination with iterative AlphaFold prediction9
Protonation states of hen egg-white lysozyme observed using D/H contrast neutron crystallography9
XFEL structure of carbonic anhydrase II: a comparative study of XFEL, NMR, X-ray and neutron structures8
Post-translational modifications in the Protein Data Bank8
Structural features of chloroplast trigger factor determined at 2.6 Å resolution8
Mechanistic insight into O=O bond formation upon model-independent visualization of the coordination geometry and ligand composition of Mn4Ca cofactor in dark-adapted photosystem II structu8
The impact of molecular variants, crystallization conditions and the space group on ligand–protein complexes: a case study on bacterial phosphotriesterase8
Protein–macrocycle polymorphism: crystal form IV of the Ralstonia solanacearum lectin–sulfonato-calix[8]arene complex8
High-resolution structures of the bound effectors avadomide (CC-122) and iberdomide (CC-220) highlight advantages and limitations of the MsCI4 soaking system8
Atomic model validation using the CCP-EM software suite8
Dynamics and Kinetics in Structural Biology: Unravelling Function Through Time-Resolved Structural Analysis. By Keith Moffat and Eaton E. Lattman. Wiley, New York, 2023, pp. 288. ISBN 978-1-1198
VitroJet: new features and case studies8
Drosophila melanogaster frataxin: protein crystal and predicted solution structure with identification of the iron-binding regions8
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