Methicillin-Resistant <i>Staphylococcus aureus</i>: Docking-Based Virtual Screening and Molecular Dynamics Simulations to Identify Potential Penicillin-Binding Protein 2a Inhibitors from Natural Flavonoids

<div>Interaction modes between residues inside the SauPBP2a active site and control positive and negative compounds. (a) Penicillin G, (b) methicillin, (c) oxadiazole, and (d) ceftobiprole. SauPBP2a, <i>Staphylococcus aureus</i> penicillin-binding protein 2a.</div>

International Journal of Microbiology

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Figure 4: Methicillin-Resistant <i>Staphylococcus aureus</i>: Docking-Based Virtual Screening and Molecular Dynamics Simulations to Identify Potential Penicillin-Binding Protein 2a Inhibitors from Natural Flavonoids 

Figure 4 | Methicillin-Resistant Staphylococcus aureus: Docking-Based Virtual Screening and Molecular Dynamics Simulations to Identify Potential Penicillin-Binding Protein 2a Inhibitors from Natural Flavonoids 