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BDBM150806 Sodium N-methylphosphate-1,3-di-O-methyl-4-O-benzyl-beta-D-glucosamine (15b)

SMILES: [Na+].CO[C@@H]1OC(CO)[C@@H](OCc2ccccc2)C(OC)[C@@H]1NP(C)([O-])=O

InChI Key: InChIKey=CURFPMRNPCZDQY-JXLIZBIESA-M

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 150806   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Peptidoglycan de-N-acetylase (PgdA)


(Streptococcus pneumoniae (Firmicutes))		BDBM150806
PNG
(Sodium N-methylphosphate-1,3-di-O-methyl-4-O-benzy...)
Show SMILES [Na+].CO[C@@H]1OC(CO)[C@@H](OCc2ccccc2)C(OC)[C@@H]1NP(C)([O-])=O |r|
Show InChI InChI=1S/C16H26NO7P/c1-21-15-13(17-25(3,19)20)16(22-2)24-12(9-18)14(15)23-10-11-7-5-4-6-8-11/h4-8,12-16,18H,9-10H2,1-3H3,(H2,17,19,20)/p-1/t12?,13-,14+,15?,16+/m0/s1
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UniProtKB/SwissProt

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PC sid
UniChem

Similars
Article
PubMed
 7.20E+5 -4.28n/an/an/an/an/a7.025



University of Toronto



Assay 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...

Chembiochem 16: 1350-6 (2015)


Article DOI: 10.1002/cbic.201500091
BindingDB Entry DOI: 10.7270/Q21N7ZTG
More data for this
Ligand-Target Pair