Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Metallo-beta-lactamase L1 type 3' and Ligand = 'BDBM50191998'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50191998 ((2R)-2-(2-(3-butylpicolinamido)-4-mercaptobutanami...) Show SMILES CCCCc1ccc(nc1)C(=O)NC(CCS)C(=O)N[C@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C23H29N3O4S/c1-2-3-7-17-10-11-18(24-15-17)21(27)25-19(12-13-31)22(28)26-20(23(29)30)14-16-8-5-4-6-9-16/h4-6,8-11,15,19-20,31H,2-3,7,12-14H2,1H3,(H,25,27)(H,26,28)(H,29,30)/t19?,20-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Virginia Curated by ChEMBL					Assay Description Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase				Bioorg Med Chem Lett 16: 5169-75 (2006) Article DOI: 10.1016/j.bmcl.2006.07.001 BindingDB Entry DOI: 10.7270/Q2WQ03DJ
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