Molecular docking of Anopheles gambiae and Aedes aegypti glutathione S-transferases epsilon 2 (GSTE2) against usnic acid: an evidence of glutathione conjugation.

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dc.publisher.country	Brasil	pt_BR
dc.publisher.initials	UFCG	pt_BR
dc.subject.cnpq	Biologia	pt_BR
dc.title	Molecular docking of Anopheles gambiae and Aedes aegypti glutathione S-transferases epsilon 2 (GSTE2) against usnic acid: an evidence of glutathione conjugation.	pt_BR
dc.date.issued	2014
dc.description.abstract	The aim of this study was to develop a theoretical model using Anopheles gambiae GSTE2 structure as template for Aedes aegypti GSTE2 by homology modeling Docking simulations were performed for both the enzymes against usnic acid in neutral and anionic forms. Ramachandran plot revealed that 93.9% of the GSTE2 model residues were located on most favored regions. Model evaluation was made by the ANOLEA and GROMOS analysis. Docking results indicated that the enzymes were able to form glutathione-conjugate with usnic acid in both the forms (anionic and neutral).	pt_BR
dc.identifier.uri	http://dspace.sti.ufcg.edu.br:8080/jspui/handle/riufcg/37594
dc.date.accessioned	2024-08-30T18:38:29Z
dc.date.available	2024-08-30
dc.date.available	2024-08-30T18:38:29Z
dc.type	Artigo de Periódico	pt_BR
dc.subject	Anopheles gambiae GSTE2	pt_BR
dc.subject	Aedes aegypti	pt_BR
dc.subject	Molecular modeling	pt_BR
dc.subject	Insecticide resistence	pt_BR
dc.subject	Modelagem molecular	pt_BR
dc.subject	Resistência a inseticidas	pt_BR
dc.rights	Acesso Aberto	pt_BR
dc.creator	MAIA, Rafael Trindade.
dc.creator	NADVORNY, Daniela.
dc.publisher	Universidade Federal de Campina Grande	pt_BR
dc.language	eng	pt_BR
dc.title.alternative	Encaixe molecular das glutationa S-transferases epsilon 2 (GSTE2) do Anopheles gambiae e do Aedes aegypti contra ácido úsnico: uma evidência de conjugação da glutationa.	pt_BR
dc.identifier.citation	MAIA, Rafael Trindade; NADVORNY, Daniela. Molecular docking of Anopheles gambiae and Aedes aegypti glutathione S-transferases epsilon 2 (GSTE2) against usnic acid: an evidence of glutathione conjugation. Brazilian Archives of Biology and Technology (Impresso), v. 57, p. 689-694, 2014. Disponível em: http://dspace.sti.ufcg.edu.br:8080/jspui/handle/riufcg/37594	pt_BR