Computational study of the mechanism of half-reactions in class 1A dihydroorotate dehydrogenase from Trypanosoma cruzi

2013 ◽  
Vol 15 (43) ◽  
pp. 18863 ◽  
Author(s):  
Natália de Farias Silva ◽  
Jerônimo Lameira ◽  
Cláudio Nahum Alves ◽  
Sergio Martí
2006 ◽  
Vol 55 (1) ◽  
pp. 11-16 ◽  
Author(s):  
Idalia Sariego ◽  
Takeshi Annoura ◽  
Takeshi Nara ◽  
Muneaki Hashimoto ◽  
Akiko Tsubouchi ◽  
...  

2002 ◽  
Vol 122 (2) ◽  
pp. 189-200 ◽  
Author(s):  
Eizo Takashima ◽  
Daniel Ken Inaoka ◽  
Arihiro Osanai ◽  
Takeshi Nara ◽  
Masao Odaka ◽  
...  

2015 ◽  
Vol 10 (6) ◽  
pp. 1934578X1501000 ◽  
Author(s):  
Frederico F. Ribeiro ◽  
Francisco J.B.M. Junior ◽  
Marcelo S. da Silva ◽  
Marcus Tullius Scotti ◽  
Luciana Scotti

Flavonoid compounds active against Trypanosoma cruzi and Leishmania species were submitted to several methodologies in silico: docking with the enzymes cruzain and trypanothione reductase (from T. cruzi), and N-myristoyltransferase, dihydroorotate dehydrogenase, and trypanothiona reductase (from Leishmania spp). Molecular maps of the complexes and the ligands were calculated. In order to compare and evaluate the antioxidant activity of the flavonoids with their antiprotozoal activity, quantum parameters were calculated. Considering the energies, interactions, and hydrophobic surfaces calculated, the flavonoids chrysin dimethyl ether against T. cruzi, and ladanein against Leishmania sp. presented the best results. The antioxidant activity did not show any correlation with anti-parasitic activity; only chrysin and its dimethyl ether showed favorable anti-parasitic results. This study hopes to contribute to existing research on these natural products against these tropical parasites.


2010 ◽  
Vol 399 (1) ◽  
pp. 13-22 ◽  
Author(s):  
Juliana Cheleski ◽  
Helton José Wiggers ◽  
Ana Paula Citadini ◽  
Antônio José da Costa Filho ◽  
Maria Cristina Nonato ◽  
...  

2017 ◽  
Vol 25 (4) ◽  
pp. 1465-1470 ◽  
Author(s):  
Daniel Ken Inaoka ◽  
Maiko Iida ◽  
Satoshi Hashimoto ◽  
Toshiyuki Tabuchi ◽  
Takefumi Kuranaga ◽  
...  

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