9QDK

Trypanosoma brucei PTR1 in complex with fragment L330 and compound F46

Summary for 9QDK

• Entry DOI: 10.2210/pdb9qdk/pdb
• Descriptor: Pteridine reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 2-amino-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one, ... (7 entities in total)
• Functional Keywords: trypanosoma brucei, pteridine reductase, ptr1, tbptr1, fragment based drug design, nadph, oxidoreductase
• Biological source: Trypanosoma brucei brucei
• Total number of polymer chains: 4
• Total formula weight: 127640.23

Authors

Landi, G.,Mangani, S.,Pozzi, C. (deposition date: 2025-03-06, release date: 2026-03-18)

• Primary citation: Linciano, P.,Landi, G.,Mangani, S.,Pozzi, C.,Costi, M.P.; Identification and optimization of Trypanosoma Brucei Pteridine-Reductase 1 Inhibitor Using Fragment-Based X-Ray Crystallography and Structure Based Drug Design; To Be Published,

Experimental method

X-RAY DIFFRACTION (1.9 Å)