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Structure paper

TitleStructural basis for the inhibitory mechanism of auranofin and gold(I) analogues against Pseudomonas aeruginosa global virulence factor regulator Vfr.
Journal, issue, pagesComput Struct Biotechnol J, Vol. 21, Page 2137-2146, Year 2023
Publish dateJul 22, 2021 (structure data deposition date)
AuthorsZhang, Y. / Chew, B.L.A. / Wang, J. / Yuan, M. / Yam, J.K.H. / Luo, D. / Yang, L.
External linksComput Struct Biotechnol J / PubMed:37007650
MethodsX-ray diffraction
Resolution1.75 - 2.8 Å
Structure data

PDB-7few:
Pseudomonas aeruginosa Virulence Factor Regulator with cAMP ligand and auranofin gold analogues
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

PDB-7ff0:
Pseudomonas aeruginosa Virulence Factor Regulator with cAMP ligand and auranofin
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

PDB-7ff8:
Pseudomonas aeruginosa Virulence Factor Regulator with cAMP ligand and Cl(triethylphosphine)gold(I)
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-7ff9:
Pseudomonas aeruginosa Virulence Factor Regulator with cAMP ligand and Cl(triethylphosphine)gold(I)
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

Chemicals

ChemComp-CMP:
ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

ChemComp-AU:
Unknown entry

ChemComp-AUF:
triethylphosphanuidylgold(1+)

ChemComp-CL:
Unknown entry

Source
  • pseudomonas aeruginosa pao1 (bacteria)
KeywordsDNA BINDING PROTEIN / cyclic AMP receptor protein / cAMP / auranofin / virulence

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