Structure-guided identification and characterization of potent inhibitors targeting PhoP and MtrA to combat mycobacteria

AbbreviationsCADD

Computer-aided drug design

CADDD

Computer-aided drug discovery and development

FP

Fluorescence polarization

LB

Luria-Bertani, LBDD, Ligand-based drug design

LSPR

Localized surface plasmon resonance

MD

Molecular dynamics, MDR, Multi-drug-resistant

MIC

Minimum inhibitory concentration

RMSD

Root mean square deviation

RMSF

Root mean square fluctuation

SBDD

Structure-based drug design

Keywords

Tuberculosis

Drug-resistant tuberculosis

Two-component signal transduction systems

Pharmacophore-based inhibitor screening

Mycobacteria

© 2024 The Authors. Published by Elsevier B.V. on behalf of Research Network of Computational and Structural Biotechnology.

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