7NPX

Thioredoxin glutathione reductase from Schistosoma mansoni in complex with 3-(3-Methoxyquinoxalin-2-yl)propanoic acid at 24 hours of soaking

Summary for 7NPX

• Entry DOI: 10.2210/pdb7npx/pdb
• Descriptor: Thioredoxin glutathione reductase, FLAVIN-ADENINE DINUCLEOTIDE, 3-(3-methoxyquinoxalin-2-yl)propanoic acid, ... (7 entities in total)
• Functional Keywords: fragment binding, redox enzyme, inhibitor, flavoreductase, protein binding
• Biological source: Schistosoma mansoni (Blood fluke)
• Total number of polymer chains: 2
• Total formula weight: 132974.34

Authors

Fata, F.,Silvestri, I.,Williams, D.L.,Angelucci, F. (deposition date: 2021-02-28, release date: 2021-05-19, Last modification date: 2024-01-31)

• Primary citation: Fata, F.,Silvestri, I.,Ardini, M.,Ippoliti, R.,Di Leandro, L.,Demitri, N.,Polentarutti, M.,Di Matteo, A.,Lyu, H.,Thatcher, G.R.J.,Petukhov, P.A.,Williams, D.L.,Angelucci, F.; Probing the Surface of a Parasite Drug Target Thioredoxin Glutathione Reductase Using Small Molecule Fragments.; Acs Infect Dis., 7:1932-1944, 2021; PubMed: 33950676; DOI: 10.1021/acsinfecdis.0c00909

Experimental method

X-RAY DIFFRACTION (2.7 Å)