BDBM50196050 CHEMBL3971298

SMILES [H][C@@]12CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@]1([H])CSCc3cc(CSC[C@H](NC(=O)[C@H](CCC(N)=O)NC2=O)C(=O)NCC(N)=O)cc(CSC[C@H](NC(=O)[C@H](C)N)C(=O)N2CCC[C@@]2([H])C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@]2([H])C(=O)N2CCC[C@@]2([H])C(=O)N1)c3

InChI Key InChIKey=ZUGIFQYZHWQIHT-VXZVMABXSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50196050   

TargetSortase family protein(Staphylococcus aureus)
Ecole Polytechnique F�D�Rale De Lausanne

Curated by ChEMBL
LigandPNGBDBM50196050(CHEMBL3971298)
Affinity DataKi:  9.30E+3nMAssay Description:Inhibition of Staphylococcus aureus His6-biotinylated SrtA expressed in Escherichia coli XL1-blue using Dabcyl-LPETG-Edans as substrate assessed as r...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed