6RFN

Crystal structure of T. brucei PDE-B1 catalytic domain with inhibitor NPD-1018

Summary for 6RFN

• Entry DOI: 10.2210/pdb6rfn/pdb
• Related: 6GXQ 6HWO 6RB6 6RCW
• Descriptor: Phosphodiesterase, ZINC ION, MAGNESIUM ION, ... (8 entities in total)
• Functional Keywords: parasitic phosphodiesterase, hydrolase, african trypanosomiasis, sleeping sickness
• Biological source: Trypanosoma brucei
• Total number of polymer chains: 2
• Total formula weight: 82973.82

Authors

Singh, A.K.,Brown, D.G. (deposition date: 2019-04-15, release date: 2019-07-24, Last modification date: 2024-01-24)

• Primary citation: de Heuvel, E.,Singh, A.K.,Boronat, P.,Kooistra, A.J.,van der Meer, T.,Sadek, P.,Blaazer, A.R.,Shaner, N.C.,Bindels, D.S.,Caljon, G.,Maes, L.,Sterk, G.J.,Siderius, M.,Oberholzer, M.,de Esch, I.J.P.,Brown, D.G.,Leurs, R.; Alkynamide phthalazinones as a new class of TbrPDEB1 inhibitors (Part 2).; Bioorg.Med.Chem., 27:4013-4029, 2019; PubMed: 31378593; DOI: 10.1016/j.bmc.2019.06.026

Experimental method

X-RAY DIFFRACTION (2.29 Å)