Halting ionic shuttle to disrupt the synthetic machinery-Structural and molecular insights into the inhibitory roles of Bedaquiline towards Mycobacterium tuberculosis ATP synthase in the treatment of tuberculosis.

Salifu, Elliasu Y; Agoni, Clement; Olotu, Fisayo A; Dokurugu, Yussif M; Soliman, Mahmoud E S

Salifu, Elliasu Y; Agoni, Clement; Olotu, Fisayo A; Dokurugu, Yussif M; Soliman, Mahmoud E S.

Afiliação

Salifu EY; Molecular Bio-computation and Drug Design Laboratory, Discipline of Pharmaceutical Chemistry, University of KwaZulu-Natal, Westville Campus, Durban, South Africa.
Agoni C; Molecular Bio-computation and Drug Design Laboratory, Discipline of Pharmaceutical Chemistry, University of KwaZulu-Natal, Westville Campus, Durban, South Africa.
Olotu FA; Molecular Bio-computation and Drug Design Laboratory, Discipline of Pharmaceutical Chemistry, University of KwaZulu-Natal, Westville Campus, Durban, South Africa.
Dokurugu YM; College of Pharmacy & Pharmaceutical Sciences, Institute of Public Health, Florida Agricultural & Mechanical University, Tallahassee, Florida.
Soliman MES; Molecular Bio-computation and Drug Design Laboratory, Discipline of Pharmaceutical Chemistry, University of KwaZulu-Natal, Westville Campus, Durban, South Africa.

J Cell Biochem ; 120(9): 16108-16119, 2019 09.

Article em En | MEDLINE | ID: mdl-31125144

Assuntos

Antituberculosos/farmacologia; Diarilquinolinas/farmacologia; ATPases Mitocondriais Próton-Translocadoras/química; ATPases Mitocondriais Próton-Translocadoras/metabolismo; Mycobacterium tuberculosis/enzimologia; Trifosfato de Adenosina/metabolismo; Proteínas de Bactérias/química; Proteínas de Bactérias/metabolismo; Domínio Catalítico; Cristalografia por Raios X; Sinergismo Farmacológico; Modelos Moleculares; Simulação de Dinâmica Molecular; Mycobacterium tuberculosis/efeitos dos fármacos; Ligação Proteica/efeitos dos fármacos; Conformação Proteica; Domínios Proteicos

Palavras-chave

Mycobacterium tuberculosis; bedaquiline; ionophores.; molecular dynamic simulation; tuberculosis

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: ATPases Mitocondriais Próton-Translocadoras / Diarilquinolinas / Mycobacterium tuberculosis / Antituberculosos Tipo de estudo: Prognostic_studies Idioma: En Ano de publicação: 2019 Tipo de documento: Article

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