Title : Docking and molecular dynamics simulation of quinone compounds with trypanocidal activity.

Pub. Date : 2009 Oct

PMID : 19263098






2 Functional Relationships(s)
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Protein Name
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1 The compounds studied displays a higher affinity in trypanothione reductase (TR) than glutathione reductase (GR), since only two out of 28 quinone compounds presented more favorable docking energy in the site of human enzyme. quinone glutathione-disulfide reductase Homo sapiens
2 The compounds studied displays a higher affinity in trypanothione reductase (TR) than glutathione reductase (GR), since only two out of 28 quinone compounds presented more favorable docking energy in the site of human enzyme. quinone glutathione-disulfide reductase Homo sapiens