Invited review: Activation of G proteins by GTP and the mechanism of Gα‐catalyzed GTP hydrolysis

SR Sprang - Biopolymers, 2016 - Wiley Online Library
This review addresses the regulatory consequences of the binding of GTP to the alpha
subunits (Gα) of heterotrimeric G proteins, the reaction mechanism of GTP hydrolysis …

Revealing atomic-level mechanisms of protein allostery with molecular dynamics simulations

S Hertig, NR Latorraca, RO Dror - PLoS computational biology, 2016 - journals.plos.org
Molecular dynamics (MD) simulations have become a powerful and popular method for the
study of protein allostery, the widespread phenomenon in which a stimulus at one site on a …

Structural basis for nucleotide exchange in heterotrimeric G proteins

RO Dror, TJ Mildorf, D Hilger, A Manglik, DW Borhani… - Science, 2015 - science.org
G protein–coupled receptors (GPCRs) relay diverse extracellular signals into cells by
catalyzing nucleotide release from heterotrimeric G proteins, but the mechanism underlying …

[PDF][PDF] Reversible ON/OFF nanoswitch for organocatalysis: mimicking the locking and unlocking operation of CaMKII

M Schmittel, S De, S Pramanik - Angewandte Chemie …, 2012 - tamaoki.es.hokudai.ac.jp
In recent years, a variety of molecular machines that are capable of changing their state in
response to external chemical, electrochemical, and photochemical stimuli have been …

β‐blockers as endocrine disruptors: the potential effects of human β‐blockers on aquatic organisms

A Massarsky, VL Trudeau… - Journal of Experimental …, 2011 - Wiley Online Library
Abstract β‐Adrenergic blockers or β‐blockers have been used therapeutically to treat human
hypertension since the late 1960s. The global market value and prescription rates of β …

Pharmacology of nonsteroidal antiinflammatory drugs and opioids

D Slater, S Kunnathil, J McBride… - Seminars in …, 2010 - thieme-connect.com
Chronic pain affects up to 50 million Americans every day. Traditional treatment has
included acetaminophen, nonsteroidal antiinflammatory drugs (NSAIDs), or opioids. The …

Using entropy of drug and protein graphs to predict FDA drug-target network: theoretic-experimental study of MAO inhibitors and hemoglobin peptides from Fasciola …

F Prado-Prado, X García-Mera, P Abeijón… - European journal of …, 2011 - Elsevier
There are many drugs described with very different affinity to a large number of receptors. In
this work, we selected Drug-Target pairs (DTPs/nDTPs) of drugs with high affinity/non-affinity …

Domain-opening and dynamic coupling in the α-subunit of heterotrimeric G proteins

XQ Yao, BJ Grant - Biophysical journal, 2013 - cell.com
Heterotrimeric G proteins are conformational switches that turn on intracellular signaling
cascades in response to the activation of G-protein-coupled receptors. Receptor activation …

Conformational fluctuations of UreG, an intrinsically disordered enzyme

F Musiani, E Ippoliti, C Micheletti, P Carloni… - Biochemistry, 2013 - ACS Publications
UreG proteins are small GTP binding (G) proteins that catalyze the hydrolysis of GTP
necessary for the maturation of urease, a virulence factor in bacterial pathogenesis. UreG …

A concerted mechanism for opening the GDP binding pocket and release of the nucleotide in hetero-trimeric G-proteins

M Louet, D Perahia, J Martinez, N Floquet - Journal of molecular biology, 2011 - Elsevier
G-protein hetero-trimers play a fundamental role in cell function. Their dynamic behavior at
the atomic level remains to be understood. We have studied the Gi hetero-trimer through a …