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1.
PLoS One ; 19(6): e0302105, 2024.
Artigo em Inglês | MEDLINE | ID: mdl-38889115

RESUMO

The present study was focused on exploring the efficient inhibitors of closed state (form) of type III effector Xanthomonas outer protein Q (XopQ) (PDB: 4P5F) from the 44 phytochemicals of Picrasma quassioides using cutting-edge computational analysis. Among them, Kumudine B showed excellent binding energy (-11.0 kcal/mol), followed by Picrasamide A, Quassidine I and Quassidine J with the targeted closed state of XopQ protein compared to the reference standard drug (Streptomycin). The molecular dynamics (MD) simulations performed at 300 ns validated the stability of top lead ligands (Kumudine B, Picrasamide A, and Quassidine I)-bound XopQ protein complex with slightly lower fluctuation than Streptomycin. The MM-PBSA calculation confirmed the strong interactions of top lead ligands (Kumudine B and QuassidineI) with XopQ protein, as they offered the least binding energy. The results of absorption, distribution, metabolism, excretion, and toxicity (ADMET) analysis confirmed that Quassidine I, Kumudine B and Picrasamide A were found to qualify most of the drug-likeness rules with excellent bioavailability scores compared to Streptomycin. Results of the computational studies suggested that Kumudine B, Picrasamide A, and Quassidine I could be considered potential compounds to design novel antibacterial drugs against X. oryzae infection. Further in vitro and in vivo antibacterial activities of Kumudine B, Picrasamide A, and Quassidine I are required to confirm their therapeutic potentiality in controlling the X. oryzae infection.


Assuntos
Antibacterianos , Simulação de Dinâmica Molecular , Xanthomonas , Antibacterianos/farmacologia , Antibacterianos/química , Xanthomonas/efeitos dos fármacos , Quimioinformática/métodos , Simulação de Acoplamento Molecular , Proteínas de Bactérias/antagonistas & inibidores , Proteínas de Bactérias/metabolismo , Proteínas de Bactérias/química
2.
Asian Pac J Cancer Prev ; 18(12): 3457-3464, 2017 Dec 29.
Artigo em Inglês | MEDLINE | ID: mdl-29286619

RESUMO

Objectives: Genetic markers are crucial fort diagnostic and prognostic investigation of hematological malignancies (HM). The conventional cytogenetic study (CCS) has been the gold standard for more than five decades. However, FISH (Fluorescence in Situ Hybridization) testing has become a popular modality owing to its targeted approach and the ability to detect abnormalities in non-mitotic cells. We here aimed to compare the diagnostic yields of a FISH panel against CCS in HMs. Methods: Samples of bone marrow and peripheral blood for a total of 201 HMs were tested for specific gene rearrangements using multi-target FISH and the results were compared with those from CCS. Results: Exhibited a greater diagnostic yield with a positive result in 39.8% of the cases, as compared to 17.9% of cases detected by CCS. Cases of chronic lymphocytic leukaemia (CLL) benefited the most by FISH testing, which identified chromosomal aberrations beyond the capacity of CCS. FISH was least beneficial in myelodysplastic syndrome (MDS) where the highest concordance with CCS was exhibited. Acute lymphocytic leukaemia (ALL) demonstrated greater benefit with CCS. In addition, we found the following abnormalities to be most prevalent in HMs by FISH panel testing: RUNX1 (21q22) amplification in ALL, deletion of D13S319/LAMP1 (13q14) in CLL, CKS1B (1q21) amplification in multiple myeloma and deletion of EGR1/RPS14 (5q31/5q32) in MDS, consistent with the literature. Conclusions: In conclusion, FISH was found to be advantageous in only a subset of HMs and cannot completely replace CCS. Utilization of the two modalities in conjunction or independently should depend on the indicated HM for an optimal approach to detecting chromosomal aberrations.


Assuntos
Povo Asiático/genética , Aberrações Cromossômicas , Análise Citogenética/métodos , Neoplasias Hematológicas/diagnóstico , Hibridização in Situ Fluorescente/métodos , Cariotipagem/métodos , Neoplasias Hematológicas/epidemiologia , Neoplasias Hematológicas/genética , Humanos , Índia/epidemiologia , Prognóstico , Encaminhamento e Consulta
3.
J Assoc Physicians India ; 61(11): 850-2, 2013 Nov.
Artigo em Inglês | MEDLINE | ID: mdl-24974508

RESUMO

Haemophagocytic lymphohistiocytosis (HLH) is a rare but potentially fatal disease of normal but overactive histiocytes and lymphocytes that commonly appears in infancy, although it has been seen in all age groups. We are reporting a series of 5 cases of HLH in young adult and paediatric patients identified over three years.


Assuntos
Medula Óssea/patologia , Linfo-Histiocitose Hemofagocítica/patologia , Adolescente , Adulto , Anti-Inflamatórios/uso terapêutico , Antineoplásicos Fitogênicos/uso terapêutico , Pré-Escolar , Dexametasona/uso terapêutico , Etoposídeo/uso terapêutico , Evolução Fatal , Feminino , Humanos , Lactente , Linfo-Histiocitose Hemofagocítica/tratamento farmacológico , Masculino , Centros de Atenção Terciária
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