Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'PBP2A' and Ligand = 'BDBM50213258'   

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
PBP2A (Staphylococcus aureus)	BDBM50213258 (CHEMBL30267) Show SMILES [Na+].[H][C@]12[C@@H](C)C(Sc3ncc(s3)-c3ccccc3)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C([O-])=O |c:18| Show InChI InChI=1S/C19H18N2O4S2/c1-9-14-13(10(2)22)17(23)21(14)15(18(24)25)16(9)27-19-20-8-12(26-19)11-6-4-3-5-7-11/h3-10,13-14,22H,1-2H3,(H,24,25)/p-1/t9-,10-,13-,14-/m1/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars		n/a	n/a	2.36E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity towards Penicillin-binding protein 2a from homogeneous MRSA COL strain using [3H]-radioligand				Citation and Details BindingDB Entry DOI: 10.7270/Q26975R5
					More data for this Ligand-Target Pair