Cargando…

Antibacterial Potency of an Active Compound from Sansevieria trifasciata Prain: An Integrated In Vitro and In Silico Study

Sansevieria trifasciata Prain holds great potential as a valuable asset in pharmaceutical development. In this study, our focus is to explore and assess the antibacterial activity of various components derived from this plant, including extracts, fractions, subfractions, and isolates, explicitly tar...

Descripción completa

Detalles Bibliográficos
Autores principales: Kasmawati, Henny, Ruslin, Ruslin, Arfan, Arfan, Sida, Nurramadhani A., Saputra, Dimas Isnu, Halimah, Eli, Mustarichie, Resmi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10457997/
https://www.ncbi.nlm.nih.gov/pubmed/37630348
http://dx.doi.org/10.3390/molecules28166096
_version_ 1785097059027648512
author Kasmawati, Henny
Ruslin, Ruslin
Arfan, Arfan
Sida, Nurramadhani A.
Saputra, Dimas Isnu
Halimah, Eli
Mustarichie, Resmi
author_facet Kasmawati, Henny
Ruslin, Ruslin
Arfan, Arfan
Sida, Nurramadhani A.
Saputra, Dimas Isnu
Halimah, Eli
Mustarichie, Resmi
author_sort Kasmawati, Henny
collection PubMed
description Sansevieria trifasciata Prain holds great potential as a valuable asset in pharmaceutical development. In this study, our focus is to explore and assess the antibacterial activity of various components derived from this plant, including extracts, fractions, subfractions, and isolates, explicitly targeting two common bacteria: Escherichia coli and Streptococcus aureus. The isolated compound, identified as a derivative pyridone alkaloid (5-methyl-11-(2-oxopyridin-1(2H)-yl)undecaneperoxoicacid), demonstrates notable antibacterial effects. The extracts, fractions, subfractions, and isolates reveal significant bacterial growth reductions (p < 0.05). The minimum inhibitory concentration (MIC) values for Escherichia coli were 1.95 ppm, 3.9 ppm, 15.62 ppm, and 7.81 ppm, respectively, while the MIC values for Streptococcus aureus were 1.95 ppm, 1.95 ppm, 15.62 ppm, and 7.81 ppm, respectively. Computational analysis showed the isolates’ interaction with key residues on the active site of β-ketoacyl-ACP synthase from Escherichia coli and TyrRS from Streptococcus aureus. The findings indicate that the isolates exhibit a strong affinity for specific residues, including His333, Cys163, and Phe392 in β-ketoacyl-ACP synthase, as well as Arg88, His117, Glu160, and Gln213 in TyrRS. Comparative energy calculations using MMPBSA demonstrate the isolates’ favorable binding energy (−104,101 kJ/mol for β-ketoacyl-ACP synthase and −81,060 kJ/mol for TyrRS) compared to ciprofloxacin. The elucidated antibacterial activity and molecular interactions of the isolates present valuable knowledge for future in vitro studies, facilitating the development of novel antibacterial agents targeting diverse bacterial strains.
format Online
Article
Text
id pubmed-10457997
institution National Center for Biotechnology Information
language English
publishDate 2023
publisher MDPI
record_format MEDLINE/PubMed
spelling pubmed-104579972023-08-27 Antibacterial Potency of an Active Compound from Sansevieria trifasciata Prain: An Integrated In Vitro and In Silico Study Kasmawati, Henny Ruslin, Ruslin Arfan, Arfan Sida, Nurramadhani A. Saputra, Dimas Isnu Halimah, Eli Mustarichie, Resmi Molecules Article Sansevieria trifasciata Prain holds great potential as a valuable asset in pharmaceutical development. In this study, our focus is to explore and assess the antibacterial activity of various components derived from this plant, including extracts, fractions, subfractions, and isolates, explicitly targeting two common bacteria: Escherichia coli and Streptococcus aureus. The isolated compound, identified as a derivative pyridone alkaloid (5-methyl-11-(2-oxopyridin-1(2H)-yl)undecaneperoxoicacid), demonstrates notable antibacterial effects. The extracts, fractions, subfractions, and isolates reveal significant bacterial growth reductions (p < 0.05). The minimum inhibitory concentration (MIC) values for Escherichia coli were 1.95 ppm, 3.9 ppm, 15.62 ppm, and 7.81 ppm, respectively, while the MIC values for Streptococcus aureus were 1.95 ppm, 1.95 ppm, 15.62 ppm, and 7.81 ppm, respectively. Computational analysis showed the isolates’ interaction with key residues on the active site of β-ketoacyl-ACP synthase from Escherichia coli and TyrRS from Streptococcus aureus. The findings indicate that the isolates exhibit a strong affinity for specific residues, including His333, Cys163, and Phe392 in β-ketoacyl-ACP synthase, as well as Arg88, His117, Glu160, and Gln213 in TyrRS. Comparative energy calculations using MMPBSA demonstrate the isolates’ favorable binding energy (−104,101 kJ/mol for β-ketoacyl-ACP synthase and −81,060 kJ/mol for TyrRS) compared to ciprofloxacin. The elucidated antibacterial activity and molecular interactions of the isolates present valuable knowledge for future in vitro studies, facilitating the development of novel antibacterial agents targeting diverse bacterial strains. MDPI 2023-08-17 /pmc/articles/PMC10457997/ /pubmed/37630348 http://dx.doi.org/10.3390/molecules28166096 Text en © 2023 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Article
Kasmawati, Henny
Ruslin, Ruslin
Arfan, Arfan
Sida, Nurramadhani A.
Saputra, Dimas Isnu
Halimah, Eli
Mustarichie, Resmi
Antibacterial Potency of an Active Compound from Sansevieria trifasciata Prain: An Integrated In Vitro and In Silico Study
title Antibacterial Potency of an Active Compound from Sansevieria trifasciata Prain: An Integrated In Vitro and In Silico Study
title_full Antibacterial Potency of an Active Compound from Sansevieria trifasciata Prain: An Integrated In Vitro and In Silico Study
title_fullStr Antibacterial Potency of an Active Compound from Sansevieria trifasciata Prain: An Integrated In Vitro and In Silico Study
title_full_unstemmed Antibacterial Potency of an Active Compound from Sansevieria trifasciata Prain: An Integrated In Vitro and In Silico Study
title_short Antibacterial Potency of an Active Compound from Sansevieria trifasciata Prain: An Integrated In Vitro and In Silico Study
title_sort antibacterial potency of an active compound from sansevieria trifasciata prain: an integrated in vitro and in silico study
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10457997/
https://www.ncbi.nlm.nih.gov/pubmed/37630348
http://dx.doi.org/10.3390/molecules28166096
work_keys_str_mv AT kasmawatihenny antibacterialpotencyofanactivecompoundfromsansevieriatrifasciataprainanintegratedinvitroandinsilicostudy
AT ruslinruslin antibacterialpotencyofanactivecompoundfromsansevieriatrifasciataprainanintegratedinvitroandinsilicostudy
AT arfanarfan antibacterialpotencyofanactivecompoundfromsansevieriatrifasciataprainanintegratedinvitroandinsilicostudy
AT sidanurramadhania antibacterialpotencyofanactivecompoundfromsansevieriatrifasciataprainanintegratedinvitroandinsilicostudy
AT saputradimasisnu antibacterialpotencyofanactivecompoundfromsansevieriatrifasciataprainanintegratedinvitroandinsilicostudy
AT halimaheli antibacterialpotencyofanactivecompoundfromsansevieriatrifasciataprainanintegratedinvitroandinsilicostudy
AT mustarichieresmi antibacterialpotencyofanactivecompoundfromsansevieriatrifasciataprainanintegratedinvitroandinsilicostudy