Inhibitory effect of natural compounds on Dihydropteroate synthase of <i>Mycobacterium leprae</i>: Molecular dynamic study.

Khan, Mahvish; Khan, Saif; Bushara, Nashwa Zaki Ali; Ali, Rafat; Tabassum, Zainab; Ishrat, Romana; Marouf, Hussein Abdel-Aziz; Sherwani, Subuhi; Mirza, Shadab; Haque, Shafiul

Inhibitory effect of natural compounds on Dihydropteroate synthase of Mycobacterium leprae: Molecular dynamic study.

Khan, Mahvish; Khan, Saif; Bushara, Nashwa Zaki Ali; Ali, Rafat; Tabassum, Zainab; Ishrat, Romana; Marouf, Hussein Abdel-Aziz; Sherwani, Subuhi; Mirza, Shadab; Haque, Shafiul.

Afiliação

Khan M; Department of Biology, College of Science, Ha'il University, Ha'il, Saudi Arabia.
Khan S; Department of Basic Dental and Medical Sciences, College of Dentistry, Ha'il University, Ha'il, Saudi Arabia.
Bushara NZA; Department of Preventive Dental Sciences, College of Dentistry, Ha'il University, Ha'il, Saudi Arabia.
Ali R; Centre for Interdisciplinary Research in Basic Sciences, Jamia Millia Islamia (Central University), New Delhi, India.
Tabassum Z; Centre for Interdisciplinary Research in Basic Sciences, Jamia Millia Islamia (Central University), New Delhi, India.
Ishrat R; Centre for Interdisciplinary Research in Basic Sciences, Jamia Millia Islamia (Central University), New Delhi, India.
Marouf HA; Department of Oral and Maxillofacial Surgery, College of Dentistry, Ha'il University, Ha'il, Saudi Arabia.
Sherwani S; Department of Biology, College of Science, Ha'il University, Ha'il, Saudi Arabia.
Mirza S; Department of Health Services Administration, College of Dentistry, Ha'il University, Ha'il, Saudi Arabia.
Haque S; Research and Scientific Studies Unit, College of Nursing & Allied Health Sciences, Jazan University, Jazan, Saudi Arabia.

J Biomol Struct Dyn ; 41(23): 13857-13872, 2023.

Article em En | MEDLINE | ID: mdl-37070201

Assuntos

Hanseníase; Mycobacterium leprae; Humanos; Hansenostáticos/farmacologia; Dapsona/farmacologia; Di-Hidropteroato Sintase/química; Di-Hidropteroato Sintase/metabolismo; Simulação de Dinâmica Molecular; Simulação de Acoplamento Molecular; Quimioterapia Combinada; Hanseníase/tratamento farmacológico

Palavras-chave

Leprosy; dihydropteroate synthase; drug discovery; drug resistance determining region; molecular docking; multiple drug therapy; natural compounds; p-amino benzoic acid

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Texto completo: 1 Base de dados: MEDLINE Assunto principal: Hanseníase / Mycobacterium leprae Idioma: En Ano de publicação: 2023 Tipo de documento: Article

Texto completo

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PubMed Links

Buscar no Google

Texto completo: 1 Base de dados: MEDLINE Assunto principal: Hanseníase / Mycobacterium leprae Idioma: En Ano de publicação: 2023 Tipo de documento: Article