5EA9

Crystal Structure of Trypanosoma cruzi Dihydroorotate Dehydrogenase in Complex with Neq0130

Summary for 5EA9

• Entry DOI: 10.2210/pdb5ea9/pdb
• Related: 5E93
• Descriptor: Dihydroorotate dehydrogenase (fumarate), 5-[(E)-3-thiophen-2-ylprop-2-enylidene]-1,3-diazinane-2,4,6-trione, GLYCEROL, ... (7 entities in total)
• Functional Keywords: t. cruzi, dihydroorotate dehydrogenase, covalent inhibitor, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• Biological source: Trypanosoma cruzi strain CL Brener
• Total number of polymer chains: 2
• Total formula weight: 71920.04

Authors

Rocha, J.R.,Inaoka, D.K.,Cheleski, J.,Shiba, T.,Harada, S.,Montanari, C.A.,Kita, K. (deposition date: 2015-10-15, release date: 2016-10-19, Last modification date: 2020-02-19)

• Primary citation: Rocha, 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 (1.71 Å)