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5E93

Crystal Structure of Trypanosoma cruzi Dihydroorotate Dehydrogenase in Complex with Neq0071

Summary for 5E93
Entry DOI10.2210/pdb5e93/pdb
Related5EA9
DescriptorDihydroorotate dehydrogenase (fumarate), 5-[(E)-3-(furan-2-yl)prop-2-enylidene]-1,3-diazinane-2,4,6-trione, GLYCEROL, ... (9 entities in total)
Functional Keywordst. cruzi, dihydroorotate dehydrogenase, covalent inhibitor, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
Biological sourceTrypanosoma cruzi strain CL Brener
Total number of polymer chains2
Total formula weight73081.84
Authors
Rocha, J.R.,Inaoka, D.K.,Cheleski, J.,Shiba, T.,Harada, S.,Montanari, C.A.,Kita, K. (deposition date: 2015-10-14, release date: 2016-10-19, Last modification date: 2020-02-19)
Primary citationRocha, J.R.,Cheleski, J.,Inaoka, D.K.,Avelar, L.A.,Ribeiro, J.F.R.,Wiggers, H.J.,Albuquerque, S.,Shiba, T.,Harada, S.,Kita, K.,Silva, A.B.F.,Montanari, C.A.
Exploring Trypanosoma cruzi Dihydroorotate Dehydrogenase Active Site Plasticity for the Discovery of Potent and Selective Inhibitors with Trypanocidal Activity
To be Published,
Experimental method
X-RAY DIFFRACTION (1.41 Å)
Structure validation

218500

數據於2024-04-17公開中

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