6PMF

Crystal Structure of EcDsbA in complex with aniline 15

Summary for 6PMF

• Entry DOI: 10.2210/pdb6pmf/pdb
• Descriptor: Thiol:disulfide interchange protein DsbA, [6-(phenylamino)-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: 42640.88

Authors

Ilyichova, O.V.,Scanlon, M.J. (deposition date: 2019-07-01, release date: 2019-11-06, Last modification date: 2023-10-11)

• Primary citation: Duncan, L.F.,Wang, G.,Ilyichova, O.V.,Scanlon, M.J.,Heras, B.,Abbott, B.M.; The Fragment-Based Development of a Benzofuran Hit as a New Class of Escherichia coli DsbA Inhibitors.; Molecules, 24:-, 2019; PubMed: 31635355; DOI: 10.3390/molecules24203756

Experimental method

X-RAY DIFFRACTION (1.95 Å)