Structure prediction and network analysis of chitinases from the Cape sundew, Drosera capensis.

ABSTRACT:

Background

Carnivorous plants possess diverse sets of enzymes with novel functionalities applicable to biotechnology, proteomics, and bioanalytical research. Chitinases constitute an important class of such enzymes, with future applications including human-safe antifungal agents and pesticides. Here, we compare chitinases from the genome of the carnivorous plant Drosera capensis to those from related carnivorous plants and model organisms.

Methods

Using comparative modeling, in silico maturation, and molecular dynamics simulation, we produce models of the mature enzymes in aqueous solution. We utilize network analytic techniques to identify similarities and differences in chitinase topology.

Results

Here, we report molecular models and functional predictions from prot

SUBMITTER: Unhelkar MH 

PROVIDER: S-EPMC6679993 | biostudies-literature | 2017 Mar

REPOSITORIES: biostudies-literature