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Mycobactin analogue interacting with siderophore efflux-pump protein: insights from molecular dynamics simulations and whole-cell assays

IntroductionIn response to continued public health emergency of antimicrobial resistance (AMR), a significant key strategy is the discovery of novel mycobacterial efflux-pump inhibitors (EPIs) as potential adjuvants in combination drug therapy. Interest in identifying new chemotypes which could pote...

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Principais autores: Mousumi Shyam, Abhishek Thakur, Caroline Velez, Chris Daniel, Orlando Acevedo, Sanjib Bhakta, Venkatesan Jayaprakash
Formato: Artigo
Idioma:Inglês
Publicado em: Frontiers Media S.A. 2024-05-01
coleção:Frontiers in Antibiotics
Assuntos:
mycobactin analogues
efflux-pump MmpL4
MmpL5
efflux-pump inhibitors
homology modelling
molecular docking
Acesso em linha:https://www.frontiersin.org/articles/10.3389/frabi.2024.1362516/full
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