4YQE

Crystal structure of E. coli WrbA in complex with benzoquinone

Summary for 4YQE

• Entry DOI: 10.2210/pdb4yqe/pdb
• Related: 2R96 2R97 2RG1 3ZHO
• Descriptor: NAD(P)H dehydrogenase (quinone), FLAVIN MONONUCLEOTIDE, 1,4-benzoquinone, ... (4 entities in total)
• Functional Keywords: flavin mononucleotide, nad(p)h dehydrogenase (quinone), oxidation-reduction, protein binding, repressor proteins, oxidoreductase
• Biological source: Escherichia coli K-12
• Total number of polymer chains: 2
• Total formula weight: 42623.43

Authors

Degtjarik, O.,Brynda, J.,Ettrichova, O.,Carey, J.,Kuta Smatanova, I.,Ettrich, R. (deposition date: 2015-03-13, release date: 2016-05-25, Last modification date: 2024-10-23)

Primary citation

Degtjarik, O.,Brynda, J.,Ettrichova, O.,Kuty, M.,Sinha, D.,Kuta Smatanova, I.,Carey, J.,Ettrich, R.,Reha, D.
Quantum Calculations Indicate Effective Electron Transfer between FMN and Benzoquinone in a New Crystal Structure of Escherichia coli WrbA.
J.Phys.Chem.B, 120:4867-4877, 2016

PubMed Abstract: Quantum mechanical calculations using the Marcus equation are applied to compare the electron-transfer probability for two distinct crystal structures of the Escherichia coli protein WrbA, an FMN-dependent

PubMed: 27183467
DOI: 10.1021/acs.jpcb.5b11958

Experimental method

X-RAY DIFFRACTION (1.33 Å)