[HTML][HTML] NMR tools to detect protein allostery

O Gampp, H Kadavath, R Riek - Current Opinion in Structural Biology, 2024 - Elsevier
Allostery is a fundamental mechanism of cellular homeostasis by intra-protein
communication between distinct functional sites. It is an internal process of proteins to steer …

Comparative Study of Receptor-, Receptor State-, and Membrane-Dependent Cholesterol Binding Sites in A2A and A1 Adenosine Receptors Using Coarse-Grained …

E Tzortzini, RA Corey, A Kolocouris - Journal of Chemical …, 2023 - ACS Publications
We used coarse-grained molecular dynamics (CG MD) simulations to study protein–
cholesterol interactions for different activation states of the A2A adenosine receptor (A2AR) …