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Structure paper

TitlePrediction and Validation of a Druggable Site on Virulence Factor of Drug Resistant Burkholderia cenocepacia*.
Journal, issue, pagesChemistry, Vol. 27, Page 10341-10348, Year 2021
Publish dateAug 5, 2020 (structure data deposition date)
AuthorsLal, K. / Bermeo, R. / Cramer, J. / Vasile, F. / Ernst, B. / Imberty, A. / Bernardi, A. / Varrot, A. / Belvisi, L.
External linksChemistry / PubMed:33769626
MethodsX-ray diffraction
Resolution1.5 - 1.9 Å
Structure data

PDB-6zzw:
Structure of the N terminal domain of Bc2L-C lectin (1-131) in complex with Globo H (H-type 3) and CAS No 912569-62-1
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-7bfy:
Structure of the apo form of the N terminal domain of Bc2L-C lectin (1-131)
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

Chemicals

ChemComp-QT5:
[3-(2-methylimidazol-1-yl)phenyl]methanamine

ChemComp-NA:
Unknown entry

ChemComp-HOH:
WATER

Source
  • burkholderia cenocepacia (strain atcc baa-245 / dsm 16553 / lmg 16656 / nctc 13227 / j2315 / cf5610) (bacteria)
  • burkholderia cenocepacia j2315 (bacteria)
KeywordsSUGAR BINDING PROTEIN / lectins / drug resistance / glycomimetics / anti-adhesive therapy / drug design / fragment based screening / fragment-based screening

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