BDBM25465 (1R,2R,5S,6S,10S,13S,15R)-5-acetyl-13-hydroxy-6,10-dimethylpentacyclo[13.2.2.0^{1,9}.0^{2,6}.0^{10,15}]nonadeca-8,18-diene-16,17-dicarboxylic acid::NSC9746

SMILES [H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC=C1[C@@]3(C)CC[C@H](O)C[C@]33C=C[C@]21C(C3C(O)=O)C(O)=O

InChI Key InChIKey=NEZTUQCJKXTWFV-JIQJOFIQSA-N

Data  1 Kd

  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 = 25465   

TargetAdenosine 5'-phosphosulfate reductase(Mycobacterium tuberculosis)
The Scripps Research Institute

LigandPNGBDBM25465((1R,2R,5S,6S,10S,13S,15R)-5-acetyl-13-hydroxy-6,10...)
Affinity DataKd:  1.27E+5nMpH: 7.5 T: 2°CAssay Description:Values of Ki were determined from the dependence of the observed rate constant (kobs) on inhibitor concentration. With subsaturing APS, the inhibit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed