Crystal structure of pteridine reductase 1 (PTR1) from Trypanosoma brucei in ternary complex with cofactor and inhibitor

Crystal structure of pteridine reductase 1 (PTR1) from Trypanosoma brucei in ternary complex with cofactor and inhibitor Descriptor: (E)-2-amino-4-oxo-6-styryl-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile, ACETATE ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... Authors: Barrack, K.L, Hunter, W.N. Deposit date: 2014-01-15 Release date: 2015-01-21 Last modified: 2024-05-08 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Structure-Based Design and Synthesis of Antiparasitic Pyrrolopyrimidines Targeting Pteridine Reductase 1. J.Med.Chem., 57, 2014布氏锥虫（Trypanosoma brucei）来源的蝶啶还原酶1（pteridine reductase 1, PTR1）与辅因子、抑制剂形成三元复合物的晶体结构。配体描述：(E)-2-氨基-4-氧代-6-苯乙烯基-4,7-二氢-3H-吡咯并[2,3-d]嘧啶-5-甲腈、乙酸根离子、烟酰胺腺嘌呤二核苷酸磷酸（NADP, Nicotinamide-Adenine-Dinucleotide Phosphate）等。作者：Barrack, K.L.、Hunter, W.N.。提交日期：2014-01-15；发布日期：2015-01-21；最后修改日期：2024-05-08。实验方法：X射线衍射（X-RAY DIFFRACTION，分辨率1.7埃（Å））。引用文献：《靶向蝶啶还原酶1的抗寄生虫吡咯并嘧啶类化合物的基于结构的设计与合成》，刊载于《药物化学杂志》（J.Med.Chem.），第57卷，2014年。