4CLE
Crystal structure of pteridine reductase 1 (PTR1) from Trypanosoma brucei in ternary complex with cofactor and inhibitor
Summary for 4CLE
Entry DOI | 10.2210/pdb4cle/pdb |
Related | 4CL8 4CLD 4CLH 4CLO 4CLR |
Descriptor | PTERIDINE REDUCTASE 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 4-(pyrrolidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine, ... (5 entities in total) |
Functional Keywords | oxidoreductase, short-chain dehydrogenase/reductase |
Biological source | TRYPANOSOMA BRUCEI BRUCEI |
Total number of polymer chains | 4 |
Total formula weight | 127176.72 |
Authors | Barrack, K.L.,Hunter, W.N. (deposition date: 2014-01-14, release date: 2015-01-21, Last modification date: 2023-12-20) |
Primary citation | Khalaf, A.I.,Huggan, J.K.,Suckling, C.J.,Gibson, C.L.,Stewart, K.,Giordani, F.,Barrett, M.P.,Wong, P.E.,Barrack, K.L.,Hunter, W.N. Structure-Based Design and Synthesis of Antiparasitic Pyrrolopyrimidines Targeting Pteridine Reductase 1. J.Med.Chem., 57:6479-, 2014 Cited by PubMed: 25007262DOI: 10.1021/JM500483B PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.8 Å) |
Structure validation
Download full validation report