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1.
Biometals ; 37(5): 1201-1224, 2024 Oct.
Artigo em Inglês | MEDLINE | ID: mdl-38864936

RESUMO

Schiff bases of existing antimicrobial drugs are an area, which is still to be comprehensively explored to improve drug efficiency against consistently resisting bacterial species. In this study, we have targeted a new and eco-friendly method of condensation reaction that allows the "green synthesis" as well as improved biological efficacy. The transition metal complexes of cefpodoxime with well-enhanced biological activities were synthesized. The condensation reaction product of cefpodoxime and vanillin was further reacted with suitable metal salts of [Mn (II), Cu (II), Fe (II), Zn (II), and Ni (II)] with 1:2 molar ratio (metal: ligand). The characterization of all the products were carried out by using UV-Visible, elemental analyzer, FTIR, 1H-NMR, ICP-OES, and LC-MS. Electronic data obtained by UV-Visible proved the octahedral geometry of metal complexes. The biological activities Schiff base ligand and its transition metal complexes were tested by using in-vitro anti-bacterial analysis against various Gram-negative, as well as Gram-positive bacterial strains. Proteinase and protein denaturation inhibition assays were utilized to evaluate the products in-vitro anti-inflammatory activities. The in vitro antioxidant activity of the ligand and its complexes was evaluated by utilizing the 2,2-diphenyl-1-picrylhydrazyl (DPPH) in-vitro method. The final results proved metal complexes to be more effective against bacterial microorganisms as compared to respective parent drug as well as their free ligands. Patch Dock, a molecular docking tool, was used to dock complexes 1a-5e with the crystal structure of GlcN-6-P synthase (ID: 1MOQ). According to the docking results, complex 2b exhibited a highest score (8,882; ACE = -580.43 kcal/mol) that is well correlated with a high inhibition as compared to other complexes which corresponds to the antibacterial screening outcomes.


Assuntos
Antibacterianos , Benzaldeídos , Ceftizoxima , Complexos de Coordenação , Testes de Sensibilidade Microbiana , Bases de Schiff , Bases de Schiff/química , Bases de Schiff/farmacologia , Bases de Schiff/síntese química , Antibacterianos/farmacologia , Antibacterianos/síntese química , Antibacterianos/química , Benzaldeídos/química , Benzaldeídos/farmacologia , Complexos de Coordenação/farmacologia , Complexos de Coordenação/química , Complexos de Coordenação/síntese química , Ceftizoxima/farmacologia , Ceftizoxima/química , Ceftizoxima/análogos & derivados , Ceftizoxima/síntese química , Simulação de Acoplamento Molecular , Bactérias Gram-Negativas/efeitos dos fármacos , Estrutura Molecular , Bactérias Gram-Positivas/efeitos dos fármacos , Antioxidantes/farmacologia , Antioxidantes/química , Antioxidantes/síntese química
2.
J Infect Public Health ; 16(2): 266-271, 2023 Feb.
Artigo em Inglês | MEDLINE | ID: mdl-36621204

RESUMO

BACKGROUND: Neonatal sepsis has high incidence with significant mortality and morbidity rates in Pakistan. We investigated common etiological patterns of neonatal sepsis at a tertiary care setup. METHODS: 90 pus and blood, gram negative and gram positive bacterial isolates were analyzed for virulence and antibiotic resistance gene profiling using PCR and disc diffusion methods. RESULTS: Staphylococcus aureus showed strong association with neonatal sepsis (43 %) followed by Citrobacter freundii (21 %), Pseudomonas aeruginosa (13 %), Escherichia coli (15 %) and Salmonella enterica (8 %). Molecular typing of E. coli isolates depicted high prevalence of the virulent F and B2 phylogroups, with 4 hypervirulent phylogroup G isolates. 76.9 % S. aureus isolates showed presence of Luk-PV, encoding for Panton-valentine leucocidin (PVL) toxin with majority also carrying MecA gene and classified as methicillin resistant S. aureus (MRSA). ecpA, papC, fimH and traT virulence genes were detected in E. coli and Salmonella isolates. 47 % Citrobacter freundii isolates carried the shiga like toxin SltII B. Antimicrobial resistance profiling depicted common resistance to cephalosporins, beta lactams and fluoroquinolones. CONCLUSION: Presence of PVL carrying MRSA and multidrug resistant gram negative bacteria, all isolated from late onset sepsis neonates indicate a predominant nosocomial transmission pattern which may complicate management of the disease in NICU setups.


Assuntos
Infecção Hospitalar , Staphylococcus aureus Resistente à Meticilina , Sepse Neonatal , Infecções Estafilocócicas , Humanos , Recém-Nascido , Antibacterianos/farmacologia , Infecção Hospitalar/epidemiologia , Escherichia coli , Exotoxinas/genética , Leucocidinas/genética , Testes de Sensibilidade Microbiana , Paquistão/epidemiologia , Prevalência , Infecções Estafilocócicas/microbiologia , Staphylococcus aureus/genética , Centros de Atenção Terciária , Resistência a Múltiplos Medicamentos
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