Identification of novel compounds against Acinetobacter baumannii 3-oxoacyl-[acyl-carrier-protein] synthase I (FabB) via comprehensive structure-based computational approaches.

Albayrak, Esra; Koçer, Sinem; Mutlu, Ozal

Albayrak, Esra; Koçer, Sinem; Mutlu, Ozal.

Afiliação

Albayrak E; Marmara University, Faculty of Science, Department of Biology, Goztepe Campus, 34722, Kadikoy, Istanbul, Turkey.
Koçer S; Istanbul Yeni Yuzyil University, Faculty of Pharmacy, Department of Pharmaceutical Biotechnology, 34010, Cevizlibag, Istanbul, Turkey.
Mutlu O; Marmara University, Faculty of Science, Department of Biology, Goztepe Campus, 34722, Kadikoy, Istanbul, Turkey. Electronic address: ozal.mutlu@marmara.edu.tr.

J Mol Graph Model ; 124: 108565, 2023 11.

Article em En | MEDLINE | ID: mdl-37454410

Assuntos

3-Oxoacil-(Proteína de Transporte de Acila) Sintase; Acinetobacter baumannii; Simulação de Acoplamento Molecular; Proteína de Transporte de Acila; Glicogênio Sintase; Ligantes; Simulação de Dinâmica Molecular; Ácidos Graxos; 3-Oxoacil-(Proteína de Transporte de Acila) Sintase/química

Palavras-chave

3-Oxoacyl-[acyl-carrier-protein] synthase I; Acinetobacter baumannii; Computer-aided drug discovery; FabB; Molecular dynamics simulation

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Texto completo: 1 Base de dados: MEDLINE Assunto principal: 3-Oxoacil-(Proteína de Transporte de Acila) Sintase / Acinetobacter baumannii Tipo de estudo: Diagnostic_studies Idioma: En Ano de publicação: 2023 Tipo de documento: Article

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