Identification of Novel Antimicrobial Compounds Targeting <i>Mycobacterium tuberculosis S</i>-Adenosyl-L-Homocysteine Hydrolase Using Dual Hierarchical In Silico Structure-Based Drug Screening

Identification of Novel Antimicrobial Compounds Targeting <i>Mycobacterium tuberculosis S</i>-Adenosyl-L-Homocysteine Hydrolase Using Dual Hierarchical In Silico Structure-Based Drug Screening

The emergence of multidrug-resistant and extensively drug-resistant <i>Mycobacterium tuberculosis</i> (<i>M. tuberculosis</i>) has become a major medical problem. <i>S</i>-adenosyl-L-homocysteine hydrolase (MtSAHH) was selected as the target protein for the identi...

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Bibliographic Details
Main Authors: Hazuki Ito, Kohei Monobe, Saya Okubo, Shunsuke Aoki
Format: Article
Language:English
Published: MDPI AG 2024-03-01
Series:Molecules
Subjects:
tuberculosis
<i>Mycobacterium</i>
<i>Mycobacterium tuberculosis S</i>-adenosyl-L-homocysteine hydrolase (MtSAHH)
in silico structure-based drug screening (SBDS)
docking simulation
molecular dynamics simulation
Online Access:https://www.mdpi.com/1420-3049/29/6/1303

Internet

https://www.mdpi.com/1420-3049/29/6/1303

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