In silico discovery of druggable targets in Citrobacter koseri using echinoderm metabolites and molecular dynamics simulation

In silico discovery of druggable targets in Citrobacter koseri using echinoderm metabolites and molecular dynamics simulation

Abstract Citrobacter koseri causes infection in people who are immunocompromised. Without effective antibiotics, these infections can become severe and life-threatening, so effective drugs are essential to treat these infections. Utilizing subtractive genomics, 2699 ORFs were predicted and translate...

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Bibliographic Details
Main Authors: Bayan A. Alhaidhal, Fatimah M. Alsulais, Ramzi A. Mothana, Abdullah R. Alanzi
Format: Article
Language:English
Published: Nature Portfolio 2024-11-01
Series:Scientific Reports
Subjects:
Citrobacter koseri
Immunocompromised
Subtractive genomics
Molecular docking
MD simulation
MMGBSA
Online Access:https://doi.org/10.1038/s41598-024-77342-5
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https://doi.org/10.1038/s41598-024-77342-5

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