Glycomimetics for the inhibition and modulation of lectins

S Leusmann, P Ménová, E Shanin, A Titz… - Chemical Society …, 2023 - pubs.rsc.org
Carbohydrates are essential mediators of many processes in health and disease. They
regulate self-/non-self-discrimination, are key elements of cellular communication, cancer …

Glycan Shape, Motions, and Interactions Explored by NMR Spectroscopy

G Widmalm - JACS Au, 2024 - ACS Publications
Glycans in the form of oligosaccharides, polysaccharides, and glycoconjugates are
ubiquitous in nature, and their structures range from linear assemblies to highly branched …

Fluorogenic Photo‐Crosslinking of Glycan‐Binding Protein Recognition Using a Fluorinated Azido‐Coumarin Fucoside

C Bousch, B Vreulz, K Kansal… - Angewandte Chemie …, 2023 - Wiley Online Library
Glycan recognition by glycan‐binding proteins is central to the biology of all living
organisms. The efficient capture and characterization of relatively weak non‐covalent …

Targeting undruggable carbohydrate recognition sites through focused fragment library design

E Shanina, S Kuhaudomlarp, E Siebs… - Communications …, 2022 - nature.com
Carbohydrate-protein interactions are key for cell-cell and host-pathogen recognition and
thus, emerged as viable therapeutic targets. However, their hydrophilic nature poses major …

Computer-aided drug design: an update

W Yu, DJ Weber, AD MacKerell Jr - Antibiotics: Methods and Protocols, 2022 - Springer
Computer-aided drug design (CADD) approaches are playing an increasingly important role
in understanding the fundamentals of ligand-receptor interactions and helping medicinal …

Allosteric modulation of SHP2: Quest from known to unknown

N Wang, S Zhu, D Lv, Y Wang… - Drug Development …, 2023 - Wiley Online Library
Src homology‐2 domain‐containing protein tyrosine phosphatase‐2 (SHP2) is a key
regulatory factor in the cell cycle and its activating mutations play an important role in the …

NMR investigations of glycan conformation, dynamics, and interactions

J Angulo, A Ardá, S Bertuzzi, A Canales… - Progress in Nuclear …, 2024 - Elsevier
Glycans are ubiquitous in nature, decorating our cells and serving as the initial points of
contact with any visiting entities. These glycan interactions are fundamental to host …

[HTML][HTML] Perspectives on Applications of 19F-NMR in Fragment-Based Drug Discovery

Q Li, CB Kang - Molecules, 2024 - mdpi.com
Fragment-based drug discovery is a powerful approach in drug discovery, applicable to a
wide range of targets. This method enables the discovery of potent compounds that can …

Features of the rare pathogen Meyerozyma guilliermondii strain SO and comprehensive in silico analyses of its adherence-contributing virulence factor agglutinin …

SJ Lim, ND Muhd Noor, S Sabri… - Journal of …, 2023 - Taylor & Francis
Meyerozyma guilliermondii is a rare yeast pathogen contributing to the deadly invasive
candidiasis. M. guilliermondii strain SO, as a promising protein expression host, showed …

Fragment-based lead discovery strategies in antimicrobial drug discovery

MI Konaklieva, BJ Plotkin - Antibiotics, 2023 - mdpi.com
Fragment-based lead discovery (FBLD) is a powerful application for developing ligands as
modulators of disease targets. This approach strategy involves identification of interactions …