Nature

Accurately predicting enzyme functions through geometric graph learning on ESMFold-predicted structures

Enzymes are crucial in numerous biological processes, with the Enzyme Commission (EC) number being a commonly used method for defining enzyme function. However, current EC number prediction ...
Nature

Parameter inference for enzyme and temperature constrained genome-scale models

The metabolism of all living organisms is dependent on temperature, and therefore, having a good method to predict temperature effects at a system level is of importance. A recently developed Bayesian ...
BioTechniques

Computational redesign of psychrophilic enzyme increases its optimum temperature

For the first time, researchers have successfully used computational simulations to modify an enzyme’s structure to increase the optimum temperature of a reaction. Researchers at Uppsala University ...
EurekAlert!

First structure of key COVID enzyme at human body temperature

UPTON, NY—Scientists studying a COVID-19 coronavirus enzyme at temperatures ranging from frosty to human-body warm discovered subtle structural shifts that offer clues about how the enzyme works. The ...