Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Metallo-beta-lactamase L1 type 3' and Ligand = 'BDBM50191990'   

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)	BDBM50191990 ((2R)-2-(4-mercapto-2-(2-(3-nitrophenyl)acetamido)b...) Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)Cc1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C21H23N3O6S/c25-19(13-15-7-4-8-16(11-15)24(29)30)22-17(9-10-31)20(26)23-18(21(27)28)12-14-5-2-1-3-6-14/h1-8,11,17-18,31H,9-10,12-13H2,(H,22,25)(H,23,26)(H,27,28)/t17?,18-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.03E+3	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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