Evaluation of interactions of silibinin with the proteins ALS3 and SAP5 against Candida albicans

Cecília Rocha da Silva, Francisca Lariza Damacieira Moura, André Luis Almeida Alves Filho, Rosana de Sousa Campos, Vitória Pessoa de Farias Cabral, Lívia Gurgel do Amaral Valente Sá, Anderson Ramos da Silva, Jacilene Silva, Akenaton Onassis Cardoso Viana Gomes, Letícia Bernardo Barbosa, Hélcio Silva dos Santos, Emmanuel Silva Marinho, Bruno Coelho Cavalcanti, Hélio Vitoriano Nobre Júnior, João Batista De Andrade Neto

Resumo


Objective: to evaluate the molecular interaction of silibinin with the targets ALS3 and SAP5. Methodology: Molecular docking protocols were conducted to analyze the binding interaction of silibinin with ALS3 and SAP5. Results: Eleven interactions of ALS3 with silibinin and four with fluconazole were found, while six interactions were observed of SAP5 with silibinin and four with fluconazole. Conclusion: Molecular docking between silibinin and ALS3 identified important interactions, but no significant interactions were observed with SAP5, even though silibinin can exhibit affinity and interactions with other SAP5 sites.


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DOI: http://dx.doi.org/10.12662/2317-3076jhbs.v10i1.4239.p1-6.2022

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Direitos autorais 2022 Journal of Health & Biological Sciences

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