4WCF
Trypanosoma brucei PTR1 in complex with inhibitor 9
Summary for 4WCF
Entry DOI | 10.2210/pdb4wcf/pdb |
Related | 2YHI 2YHU 4WCD |
Descriptor | Pteridine reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 3-(5-amino-1,3,4-thiadiazol-2-yl)pyridin-4-amine, ... (8 entities in total) |
Functional Keywords | oxidoreductase |
Biological source | Trypanosoma brucei brucei More |
Total number of polymer chains | 4 |
Total formula weight | 118250.57 |
Authors | Mangani, S.,Di Pisa, F.,Pozzi, C. (deposition date: 2014-09-04, release date: 2015-09-23, Last modification date: 2024-01-10) |
Primary citation | Linciano, P.,Dawson, A.,Pohner, I.,Costa, D.M.,Sa, M.S.,Cordeiro-da-Silva, A.,Luciani, R.,Gul, S.,Witt, G.,Ellinger, B.,Kuzikov, M.,Gribbon, P.,Reinshagen, J.,Wolf, M.,Behrens, B.,Hannaert, V.,Michels, P.A.M.,Nerini, E.,Pozzi, C.,di Pisa, F.,Landi, G.,Santarem, N.,Ferrari, S.,Saxena, P.,Lazzari, S.,Cannazza, G.,Freitas-Junior, L.H.,Moraes, C.B.,Pascoalino, B.S.,Alcantara, L.M.,Bertolacini, C.P.,Fontana, V.,Wittig, U.,Muller, W.,Wade, R.C.,Hunter, W.N.,Mangani, S.,Costantino, L.,Costi, M.P. Exploiting the 2-Amino-1,3,4-thiadiazole Scaffold To Inhibit Trypanosoma brucei Pteridine Reductase in Support of Early-Stage Drug Discovery. ACS Omega, 2:5666-5683, 2017 Cited by PubMed: 28983525DOI: 10.1021/acsomega.7b00473 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.93 Å) |
Structure validation
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