Molecular Docking and In Vitro Evaluation of Violacein-Alginate Beads for Targeted Inhibition of <i>Staphylococcus aureus</i> Biofilm Formation

Violacein, produced by <i>Chromobacterium violaceum</i>, exhibits significant antibacterial, antiviral, antifungal, and antioxidant properties. However, its poor aqueous solubility substantially limits its bioavailability. To overcome this constraint, violacein was encapsulated in sodium alginate beads, and its antibiofilm efficacy against <i>Staphylococcus aureus</i> was evaluated. Violacein-loaded alginate beads (VIABs) were synthesized and characterized using Fourier-transform infrared spectroscopy, scanning electron microscopy, and ultraviolet-visible spectrophotometry. Molecular docking analysis was further conducted to examine the interactions between violacein and the <i>icaADBC</i> proteins (UniProt accession: Q9RQP9, Q9RQP8, Q9RQP7, andQ9RQP6 ), which play a critical role in polysaccharide intercellular adhesin production during biofilm formation. The crude violacein extract displayed antibacterial activity, generating an inhibition zone of 12.3 ± 0.5 mm against <i>S. aureus</i>. The average particle sizes of dry alginate beads and violacein-loaded alginate beads were 0.97 ± 0.16 and 0.66 ± 0.11 mm, respectively. VIABs (20-5 mg/mL) significantly suppressed <i>S. aureus</i> biofilm formation by 77.4, 67.4, and 46.8%. Molecular docking analysis demonstrated strong binding affinities between violacein and the target proteins. Furthermore, violacein adhered to Lipinski's Rule of Five, suggesting favorable pharmacokinetic properties. These findings highlight the potential of VIABs as a promising therapeutic and food preservative agent due to their potent antibiofilm activity.

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Publication Details

Journal
ACS Omega
Published
2025-07-16
DOI
https://doi.org/10.1021/acsomega.5c03106
Citations
1
Primary Topic
Microbial Metabolism and Applications
Type
article
Field-Weighted Citation Impact
1.23

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article

Molecular Docking and In Vitro Evaluation of Violacein-Alginate Beads for Targeted Inhibition of Staphylococcus aureus Biofilm Formation

Neslihan Kaya Kınaytürk, Seyhan Ulusoy, Çağdaş Deniz Peri̇z
1 citations
ACS Omega
Microbial Metabolism and Applications
1.23
article

Molecular Docking and In Vitro Evaluation of Violacein-Alginate Beads for Targeted Inhibition of Staphylococcus aureus Biofilm Formation

Neslihan Kaya Kınaytürk, Seyhan Ulusoy, Çağdaş Deniz Peri̇z
article en
1 citations

Abstract

Violacein, produced by <i>Chromobacterium violaceum</i>, exhibits significant antibacterial, antiviral, antifungal, and antioxidant properties. However, its poor aqueous solubility substantially limits its bioavailability. To overcome this constraint, violacein was encapsulated in sodium alginate beads, and its antibiofilm efficacy against <i>Staphylococcus aureus</i> was evaluated. Violacein-loaded alginate beads (VIABs) were synthesized and characterized using Fourier-transform infrared spectroscopy, scanning electron microscopy, and ultraviolet-visible spectrophotometry. Molecular docking analysis was further conducted to examine the interactions between violacein and the <i>icaADBC</i> proteins (UniProt accession: Q9RQP9, Q9RQP8, Q9RQP7, andQ9RQP6 ), which play a critical role in polysaccharide intercellular adhesin production during biofilm formation. The crude violacein extract displayed antibacterial activity, generating an inhibition zone of 12.3 ± 0.5 mm against <i>S. aureus</i>. The average particle sizes of dry alginate beads and violacein-loaded alginate beads were 0.97 ± 0.16 and 0.66 ± 0.11 mm, respectively. VIABs (20-5 mg/mL) significantly suppressed <i>S. aureus</i> biofilm formation by 77.4, 67.4, and 46.8%. Molecular docking analysis demonstrated strong binding affinities between violacein and the target proteins. Furthermore, violacein adhered to Lipinski's Rule of Five, suggesting favorable pharmacokinetic properties. These findings highlight the potential of VIABs as a promising therapeutic and food preservative agent due to their potent antibiofilm activity.

ACS OmegaVol. 10(29)
Center for NanoScience (DE), Centre de Nanosciences et de Nanotechnologies (FR), Suleyman Demirel University (KZ), Applied Natural Sciences (US), Burdur Mehmet Akif Ersoy Üniversitesi (TR)
Türkiye Bilimsel ve Teknolojik Araştırma Kurumu, Süleyman Demirel Üniversitesi, Yükseköğretim Kurulu
Zero hunger
Openalex Percentile: Top 20%
Microbial Metabolism and Applications
1.23
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