Matches in SemOpenAlex for { <https://semopenalex.org/work/W4308773196> ?p ?o ?g. }
- W4308773196 endingPage "1094" @default.
- W4308773196 startingPage "1094" @default.
- W4308773196 abstract "Methicillin-resistant Staphylococcus aureus (MRSA) infections are increasingly causing morbidity and mortality; thus, drugs with multifunctional efficacy against MRSA are needed. We extracted a novel compound from the halophilic Pseudomonas aeruginosa using an ethyl acetate (HPAEtOAcE). followed by purification and structure elucidation through HPLC, LCMS, and 1H and 13C NMR, revealing the novel 5-(1H-indol-3-yl)-4-pentyl-1,3-oxazole-2-carboxylic acid (Compound 1). Molecular docking of the compound against the MRSA PS (pantothenate synthetase) protein was confirmed using the CDOCKER algorithm in BDS software with specific binding to the amino acids Arg (B:188) and Lys (B:150) through covalent hydrogen bonding. Molecular dynamic simulation of RMSD revealed that the compound-protein complex was stabilized. The proficient bioactivities against MRSA were attained by the HPAEtOAcE, including MIC and MBCs, which were 0.64 and 1.24 µg/mL, respectively; 100% biomass inhibition and 99.84% biofilm inhibition were observed with decayed effects by CLSM and SEM at 48 h. The hla, IrgA, and SpA MRSA genes were downregulated in RT-PCR. Non-hemolytic and antioxidant potential in the DPPH assay were observed at 10 mg/mL and IC50 29.75 ± 0.38 by the HPAEtOAcE. In vitro growth inhibition assays on MRSA were strongly supported by in silico molecular docking; Lipinski's rule on drug-likeness and ADMET toxicity prediction indicated the nontoxic nature of compound." @default.
- W4308773196 created "2022-11-15" @default.
- W4308773196 creator A5010421862 @default.
- W4308773196 creator A5017330239 @default.
- W4308773196 creator A5032667138 @default.
- W4308773196 creator A5045317435 @default.
- W4308773196 creator A5064760991 @default.
- W4308773196 creator A5077603986 @default.
- W4308773196 creator A5083564118 @default.
- W4308773196 creator A5083993677 @default.
- W4308773196 date "2022-11-10" @default.
- W4308773196 modified "2023-10-18" @default.
- W4308773196 title "Bioactive Efficacy of Novel Carboxylic Acid from Halophilic Pseudomonas aeruginosa against Methicillin-Resistant Staphylococcus aureus" @default.
- W4308773196 cites W1576277845 @default.
- W4308773196 cites W1748063039 @default.
- W4308773196 cites W1853764526 @default.
- W4308773196 cites W1948725849 @default.
- W4308773196 cites W1977571916 @default.
- W4308773196 cites W1980353574 @default.
- W4308773196 cites W1990608769 @default.
- W4308773196 cites W2007949559 @default.
- W4308773196 cites W2011596188 @default.
- W4308773196 cites W2012085557 @default.
- W4308773196 cites W2013532536 @default.
- W4308773196 cites W2033197878 @default.
- W4308773196 cites W2034621610 @default.
- W4308773196 cites W2035274199 @default.
- W4308773196 cites W2038440750 @default.
- W4308773196 cites W2042210128 @default.
- W4308773196 cites W2049041145 @default.
- W4308773196 cites W2052836701 @default.
- W4308773196 cites W2075359954 @default.
- W4308773196 cites W2084244621 @default.
- W4308773196 cites W2084340897 @default.
- W4308773196 cites W2095894402 @default.
- W4308773196 cites W2117151586 @default.
- W4308773196 cites W2131943957 @default.
- W4308773196 cites W2132191725 @default.
- W4308773196 cites W2140831068 @default.
- W4308773196 cites W2150865677 @default.
- W4308773196 cites W2166164435 @default.
- W4308773196 cites W2249611388 @default.
- W4308773196 cites W2268073084 @default.
- W4308773196 cites W2272438906 @default.
- W4308773196 cites W2292286035 @default.
- W4308773196 cites W2295278142 @default.
- W4308773196 cites W2300793209 @default.
- W4308773196 cites W2312720395 @default.
- W4308773196 cites W2324411776 @default.
- W4308773196 cites W2367645528 @default.
- W4308773196 cites W2479960072 @default.
- W4308773196 cites W2685623541 @default.
- W4308773196 cites W2730366992 @default.
- W4308773196 cites W2735329605 @default.
- W4308773196 cites W2756818201 @default.
- W4308773196 cites W2761759734 @default.
- W4308773196 cites W2766272099 @default.
- W4308773196 cites W2775512586 @default.
- W4308773196 cites W2788566509 @default.
- W4308773196 cites W2807342767 @default.
- W4308773196 cites W2811008670 @default.
- W4308773196 cites W2903381708 @default.
- W4308773196 cites W2908418786 @default.
- W4308773196 cites W2911355466 @default.
- W4308773196 cites W2912040129 @default.
- W4308773196 cites W2912673401 @default.
- W4308773196 cites W2948572687 @default.
- W4308773196 cites W2950340825 @default.
- W4308773196 cites W2956229469 @default.
- W4308773196 cites W2961826554 @default.
- W4308773196 cites W2963165134 @default.
- W4308773196 cites W2966893893 @default.
- W4308773196 cites W2967370186 @default.
- W4308773196 cites W2992456596 @default.
- W4308773196 cites W2996966685 @default.
- W4308773196 cites W3002189575 @default.
- W4308773196 cites W3031223968 @default.
- W4308773196 cites W3042829280 @default.
- W4308773196 cites W3085571076 @default.
- W4308773196 cites W3087014489 @default.
- W4308773196 cites W3102474828 @default.
- W4308773196 cites W3123104113 @default.
- W4308773196 cites W3129945141 @default.
- W4308773196 cites W3135796754 @default.
- W4308773196 cites W3136595192 @default.
- W4308773196 cites W3166285178 @default.
- W4308773196 cites W3170112215 @default.
- W4308773196 cites W3183738599 @default.
- W4308773196 cites W3185076871 @default.
- W4308773196 cites W3195737959 @default.
- W4308773196 cites W3200780646 @default.
- W4308773196 cites W3201149844 @default.
- W4308773196 cites W4213239603 @default.
- W4308773196 cites W4223505908 @default.
- W4308773196 cites W4224294100 @default.
- W4308773196 cites W4224309895 @default.
- W4308773196 cites W4229042040 @default.
- W4308773196 cites W4229832919 @default.