Compile Data Set for Download or QSAR

Found 1 hit of ec50 data for polymerid = 5707   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Fucose-binding lectin PA-IIL (Pseudomonas aeruginosa)	BDBM103982 (LecB Inhibitor Ligand 6) Show SMILES CC1O[C@@H](OCCNC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](O)C(O)[C@@H]1O |r,wU:36.40,3.3,wD:40.45,(41.47,-13.76,;42.95,-13.36,;44.44,-13.76,;45.93,-13.36,;45.93,-11.82,;47.26,-11.05,;48.6,-11.82,;48.6,-13.36,;49.93,-14.13,;49.93,-15.67,;51.26,-13.36,;51.26,-11.82,;52.6,-11.05,;52.6,-9.51,;51.26,-8.74,;49.93,-9.51,;49.93,-11.05,;48.87,-8.97,;48.87,-7.69,;47.81,-9.74,;51.26,-7.2,;52.6,-6.43,;53.93,-7.2,;55.27,-6.43,;55.27,-4.89,;56.6,-4.12,;53.93,-4.12,;52.6,-4.89,;51.26,-4.12,;49.93,-4.89,;48.6,-4.12,;47.26,-4.89,;45.93,-4.12,;47.26,-6.43,;48.6,-7.2,;49.93,-6.43,;44.84,-14.45,;46.33,-14.06,;43.35,-14.06,;42.74,-15.14,;41.87,-14.45,;41.87,-15.99,)| Show InChI InChI=1S/C29H28N2O10S/c1-13-24(34)25(35)26(36)28(40-13)39-9-8-30-29(42)31-14-2-5-17(20(10-14)27(37)38)23-18-6-3-15(32)11-21(18)41-22-12-16(33)4-7-19(22)23/h2-7,10-13,24-26,28,32,34-36H,8-9H2,1H3,(H,37,38)(H2,30,31,42)/t13?,24-,25?,26+,28-/m1/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.74E+3	n/a	697	n/a	n/a	n/a	n/a
University of Konstanz									ACS Chem Biol 8: 1775-84 (2013) Article DOI: 10.1021/cb400371r BindingDB Entry DOI: 10.7270/Q21J98C3
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