Allosteric sodium in class A GPCR signaling
V Katritch, G Fenalti, EE Abola, BL Roth… - Trends in biochemical …, 2014 - cell.com
Despite their functional and structural diversity, G-protein-coupled receptors (GPCRs) share
a common mechanism of signal transduction via conformational changes in the seven …
a common mechanism of signal transduction via conformational changes in the seven …
The roles of water in the protein matrix: a largely untapped resource for drug discovery
F Spyrakis, MH Ahmed, AS Bayden… - Journal of medicinal …, 2017 - ACS Publications
The value of thoroughly understanding the thermodynamics specific to a drug
discovery/design study is well known. Over the past decade, the crucial roles of water …
discovery/design study is well known. Over the past decade, the crucial roles of water …
Common activation mechanism of class A GPCRs
Class A G-protein-coupled receptors (GPCRs) influence virtually every aspect of human
physiology. Understanding receptor activation mechanism is critical for discovering novel …
physiology. Understanding receptor activation mechanism is critical for discovering novel …
GPCRmd uncovers the dynamics of the 3D-GPCRome
I Rodríguez-Espigares, M Torrens-Fontanals… - Nature …, 2020 - nature.com
G-protein-coupled receptors (GPCRs) are involved in numerous physiological processes
and are the most frequent targets of approved drugs. The explosion in the number of new …
and are the most frequent targets of approved drugs. The explosion in the number of new …
Activation of G-protein-coupled receptors correlates with the formation of a continuous internal water pathway
Recent crystal structures of G-protein-coupled receptors (GPCRs) have revealed ordered
internal water molecules, raising questions about the functional role of those waters for …
internal water molecules, raising questions about the functional role of those waters for …
How μ-opioid receptor recognizes fentanyl
Roughly half of the drug overdose-related deaths in the United States are related to
synthetic opioids represented by fentanyl which is a potent agonist of mu-opioid receptor …
synthetic opioids represented by fentanyl which is a potent agonist of mu-opioid receptor …
Structural insights into emergent signaling modes of G protein–coupled receptors
I Sutkeviciute, JP Vilardaga - Journal of Biological Chemistry, 2020 - ASBMB
G protein–coupled receptors (GPCRs) represent the largest family of cell membrane
proteins, with> 800 GPCRs in humans alone, and recognize highly diverse ligands, ranging …
proteins, with> 800 GPCRs in humans alone, and recognize highly diverse ligands, ranging …
Fentanyl and the fluorinated fentanyl derivative NFEPP elicit distinct hydrogen-bond dynamics of the opioid receptor
The development of safe therapeutics to manage pain is of central interest for biomedical
applications. The fluorinated fentanyl derivative N-(3-fluoro-1-phenethylpiperidin-4-yl)-N …
applications. The fluorinated fentanyl derivative N-(3-fluoro-1-phenethylpiperidin-4-yl)-N …
Symmetry, rigidity, and allosteric signaling: from monomeric proteins to molecular machines
Allosteric signaling in biological molecules, which may be viewed as specific action at a
distance due to localized perturbation upon binding of ligands or changes in environmental …
distance due to localized perturbation upon binding of ligands or changes in environmental …
New binding sites, new opportunities for GPCR drug discovery
Many central biological events rely on protein–ligand interactions. The identification and
characterization of protein-binding sites for ligands are crucial for the understanding of …
characterization of protein-binding sites for ligands are crucial for the understanding of …