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Structure paper

TitleStructure Guided Development of Potent Reversibly Binding Penicillin Binding Protein Inhibitors
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 2, Page 219-, Year 2011
Publish dateJul 7, 2010 (structure data deposition date)
AuthorsWoon, E.C.Y. / Zervosen, A. / Sauvage, E. / Simmons, K.J. / Ivec, M. / Inglis, S.R. / Fishwick, C.W.G. / Gobec, S. / Charlier, P. / Luxen, A. / Schofield, C.J.
External linksAcs Med. Chem. Lett. / PubMed:24900305
MethodsX-ray diffraction
Resolution2.4 - 2.8 Å
Structure data

PDB-2xk1:
Crystal structure of a complex between Actinomadura R39 DD-peptidase and a boronate inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-2xln:
Crystal structure of a complex between Actinomadura R39 DD-peptidase and a boronate inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

Chemicals

ChemComp-EWB:
[(1S)-1-{[(2-benzylphenyl)carbonyl]amino}ethyl](trihydroxy)borate(1-)

ChemComp-SO4:
SULFATE ION

ChemComp-CO:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-EWA:
[(1S)-1-{[(2,6-DIMETHOXYPHENYL)CARBONYL]AMINO}ETHYL]BORONIC ACID

Source
  • actinomadura sp (bacteria)
KeywordsHYDROLASE / PEPTIDOGLYCAN

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