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SMILES: [Na+].[H][C@]12[C@@H](C)C(Sc3nc4c(CO)csc4s3)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C([O-])=O

InChI Key: InChIKey=BUYXSZJYKNBUJZ-LTNPLRIYSA-M

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50213269   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
PBP2A


(Staphylococcus aureus)		BDBM50213269
PNG
(CHEMBL430721)
Show SMILES [Na+].[H][C@]12[C@@H](C)C(Sc3nc4c(CO)csc4s3)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C([O-])=O |c:17|
Show InChI InChI=1S/C16H16N2O5S3/c1-5-10-8(6(2)20)13(21)18(10)11(14(22)23)12(5)25-16-17-9-7(3-19)4-24-15(9)26-16/h4-6,8,10,19-20H,3H2,1-2H3,(H,22,23)/p-1/t5-,6-,8-,10-/m1/s1
PDB

UniProtKB/TrEMBL

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
n/an/a 2.76E+3n/an/an/an/an/an/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