BDBM150808 Sodium N-methylphosphate-1-O-methyl-6-O-benzyl-beta-D-glucosamine (15d)

SMILES [Na+].CO[C@@H]1OC(COCc2ccccc2)[C@@H](O)C(O)[C@@H]1NP(C)([O-])=O

InChI Key InChIKey=GISPSYRPYPRXLB-UHFFFAOYSA-M

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 150808   

TargetPeptidoglycan-N-acetylglucosamine deacetylase(Streptococcus pneumoniae)
University of Toronto

LigandPNGBDBM150808(Sodium N-methylphosphate-1-O-methyl-6-O-benzyl-bet...)
Affinity DataKi:  5.80E+5nM ΔG°:  -4.41kcal/molepH: 7.0 T: 2°CAssay Description:In a standard optimized reaction, SpPgdA was added to a microcentrifuge tube and incubated at 30 °C for 5 min. Chitotriose was added as a substrate t...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2015
Entry Details Article
PubMed
TargetPoly-beta-1,6-N-acetyl-D-glucosamine N-deacetylase(Escherichia coli (strain K12))
University of Toronto

LigandPNGBDBM150808(Sodium N-methylphosphate-1-O-methyl-6-O-benzyl-bet...)
Affinity DataKi: >1.00E+6nMpH: 7.5Assay Description:Reactions were carried out in solutions (50 µL) containing PgaB (10 µM) in HEPES (100 mM, pH 7.5), and varying concentrations of ACC (0.05-10 mM) at ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2015
Entry Details Article
PubMed