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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fucose-binding lectin PA-IIL' and Ligand = 'BDBM104008'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Fucose-binding lectin PA-IIL


(Pseudomonas aeruginosa)
BDBM104008
PNG
(LecB Inhibitor Sulfonamides 5g)
Show SMILES COC1O[C@H](CNS(=O)(=O)\C=C\c2ccccc2)[C@@H](O)C(O)[C@@H]1O |r|
Show InChI InChI=1S/C15H21NO7S/c1-22-15-14(19)13(18)12(17)11(23-15)9-16-24(20,21)8-7-10-5-3-2-4-6-10/h2-8,11-19H,9H2,1H3/b8-7+/t11-,12-,13?,14+,15?/m1/s1
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.69E+4n/an/an/an/an/an/a



University of Konstanz





ACS Chem Biol 8: 1775-84 (2013)


Article DOI: 10.1021/cb400371r
BindingDB Entry DOI: 10.7270/Q21J98C3
More data for this
Ligand-Target Pair