6QU4

Crystal Structure of Phosphofructokinase from Trypanosoma brucei in complex with an allosteric inhibitor ctcb405

Summary for 6QU4

Entry DOI	10.2210/pdb6qu4/pdb
Descriptor	ATP-dependent 6-phosphofructokinase, 1-[(3,4-dichlorophenyl)methyl]-5-[2-(dimethylamino)ethyl]pyrrolo[3,2-c]pyridin-4-one, CITRIC ACID, ... (5 entities in total)
Functional Keywords	glycolysis, inhibitor, allostery, transferase
Biological source	Trypanosoma brucei brucei
Total number of polymer chains	4
Total formula weight	225652.78
Authors	McNae, I.W.,Dornan, J.,Walkinshaw, M.D. (deposition date: 2019-02-26, release date: 2020-03-18, Last modification date: 2024-01-24)
Primary citation	McNae, I.W.,Kinkead, J.,Malik, D.,Yen, L.H.,Walker, M.K.,Swain, C.,Webster, S.P.,Gray, N.,Fernandes, P.M.,Myburgh, E.,Blackburn, E.A.,Ritchie, R.,Austin, C.,Wear, M.A.,Highton, A.J.,Keats, A.J.,Vong, A.,Dornan, J.,Mottram, J.C.,Michels, P.A.M.,Pettit, S.,Walkinshaw, M.D. Fast acting allosteric phosphofructokinase inhibitors block trypanosome glycolysis and cure acute African trypanosomiasis in mice. Nat Commun, 12:1052-1052, 2021 Cited by PubMed: 33594070 DOI: 10.1038/s41467-021-21273-6 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.75 Å)

Structure validation