7LHP
Crystal Structure of EcDsbA in a complex with methyl 2-(6-bromo-2-phenylbenzofuran-3-yl)acetate
Summary for 7LHP
Entry DOI | 10.2210/pdb7lhp/pdb |
Descriptor | Thiol:disulfide interchange protein DsbA, (6-bromo-2-phenyl-1-benzofuran-3-yl)acetic acid, COPPER (II) ION, ... (4 entities in total) |
Functional Keywords | disulfide oxidoreductase, redox protein, oxidoreductase-inhibitor complex, oxidoreductase, oxidoreductase/inhibitor |
Biological source | Escherichia coli (strain K12) |
Total number of polymer chains | 2 |
Total formula weight | 42704.76 |
Authors | Ilyichova, O.V.,Scanlon, M.J. (deposition date: 2021-01-26, release date: 2021-08-11, Last modification date: 2023-10-18) |
Primary citation | Duncan, L.F.,Wang, G.,Ilyichova, O.V.,Dhouib, R.,Totsika, M.,Scanlon, M.J.,Heras, B.,Abbott, B.M. Elaboration of a benzofuran scaffold and evaluation of binding affinity and inhibition of Escherichia coli DsbA: A fragment-based drug design approach to novel antivirulence compounds. Bioorg.Med.Chem., 45:116315-116315, 2021 Cited by PubMed: 34364222DOI: 10.1016/j.bmc.2021.116315 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.9 Å) |
Structure validation
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