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 Cited by PubMed: 33950676DOI: 10.1021/acsinfecdis.0c00909 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.7 Å) |
Structure validation
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