Structure-guided optimization of D-captopril for discovery of potent NDM-1 inhibitors.

Ma, Guixing; Wang, Sanshan; Wu, Kebin; Zhang, Weizhe; Ahmad, Ashfaq; Hao, Quan; Lei, Xiaoguang; Zhang, Hongmin

Ma, Guixing; Wang, Sanshan; Wu, Kebin; Zhang, Weizhe; Ahmad, Ashfaq; Hao, Quan; Lei, Xiaoguang; Zhang, Hongmin.

Afiliação

Ma G; Department of Biology, Guangdong Provincial Key Laboratory of Cell Microenvironment and Disease Research and Shenzhen Key Laboratory of Cell Microenvironment, Southern University of Science and Technology, Shenzhen 518055, Guangdong, China.
Wang S; Beijing National Laboratory for Molecular Sciences, Key Laboratory of Bioorganic Chemistry and Molecular Engineering of Ministry of Education, Department of Chemical Biology, College of Chemistry and Molecular Engineering, Synthetic and Functional Biomolecules Center and Peking-Tsinghua Center for L
Wu K; Department of Biology, Guangdong Provincial Key Laboratory of Cell Microenvironment and Disease Research and Shenzhen Key Laboratory of Cell Microenvironment, Southern University of Science and Technology, Shenzhen 518055, Guangdong, China.
Zhang W; School of Biomedical Sciences, The University of Hong Kong, Hong Kong Special Administrative Region.
Ahmad A; Department of Biology, Guangdong Provincial Key Laboratory of Cell Microenvironment and Disease Research and Shenzhen Key Laboratory of Cell Microenvironment, Southern University of Science and Technology, Shenzhen 518055, Guangdong, China.
Hao Q; School of Biomedical Sciences, The University of Hong Kong, Hong Kong Special Administrative Region. Electronic address: qhao@hku.hk.
Lei X; Beijing National Laboratory for Molecular Sciences, Key Laboratory of Bioorganic Chemistry and Molecular Engineering of Ministry of Education, Department of Chemical Biology, College of Chemistry and Molecular Engineering, Synthetic and Functional Biomolecules Center and Peking-Tsinghua Center for L
Zhang H; Department of Biology, Guangdong Provincial Key Laboratory of Cell Microenvironment and Disease Research and Shenzhen Key Laboratory of Cell Microenvironment, Southern University of Science and Technology, Shenzhen 518055, Guangdong, China. Electronic address: zhanghm@sustech.edu.cn.

Bioorg Med Chem ; 29: 115902, 2021 01 01.

Article em En | MEDLINE | ID: mdl-33302045

Assuntos

Antibacterianos/química; Captopril/química; Inibidores de beta-Lactamases/química; beta-Lactamases/metabolismo; Antibacterianos/metabolismo; Antibacterianos/farmacologia; Proteínas de Bactérias/química; Sítios de Ligação; Captopril/metabolismo; Captopril/farmacologia; Cristalografia por Raios X; Descoberta de Drogas; Resistência Microbiana a Medicamentos/efeitos dos fármacos; Humanos; Hidrólise/efeitos dos fármacos; Modelos Moleculares; Ligação Proteica; Relação Estrutura-Atividade; Compostos de Sulfidrila/química; Inibidores de beta-Lactamases/metabolismo; Inibidores de beta-Lactamases/farmacologia

Palavras-chave

Antibiotic resistance; D-captopril derivatives; Drug discovery; Metallo-ß-lactamase inhibitors; Metallo-ß-lactamases (MBLs); Thiol compounds

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Beta-Lactamases / Captopril / Inibidores de beta-Lactamases / Antibacterianos Limite: Humans Idioma: En Revista: Bioorg Med Chem Assunto da revista: BIOQUIMICA / QUIMICA Ano de publicação: 2021 Tipo de documento: Article País de afiliação: China

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