BDBM50280172 1,3,4-Trihydroxy-5-phosphonomethyl-cyclohexanecarboxylic acid::CHEMBL281425

SMILES C1[C@@H]([C@H]([C@@H](C[C@@]1(C(=O)O)O)O)O)CP(=O)(O)O

InChI Key InChIKey=BKLICLLAHMTUPK-UHFFFAOYSA-N

Data  1 KI  2 Koff  1 Kon

PDB links: 9 PDB IDs match this monomer.

  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 3 hits for monomerid = 50280172   

Target3-dehydroquinate synthase(Escherichia coli (strain K12))
TBA

Curated by ChEMBL
LigandPNGBDBM50280172(1,3,4-Trihydroxy-5-phosphonomethyl-cyclohexanecarb...)
Affinity DataKon:  0.000750M-1s-1 Koff:  1.40E+5s-1Assay Description:Rate constant against 3-dehydroquinate synthaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2010
Entry Details Article

Target3-dehydroquinate synthase(Escherichia coli (strain K12))
TBA

Curated by ChEMBL
LigandPNGBDBM50280172(1,3,4-Trihydroxy-5-phosphonomethyl-cyclohexanecarb...)
Affinity DataKon:  0.000750M-1s-1Assay Description:Association rate constant against 3-dehydroquinate synthaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2010
Entry Details Article

Target3-dehydroquinate synthase(Escherichia coli (strain K12))
TBA

Curated by ChEMBL
LigandPNGBDBM50280172(1,3,4-Trihydroxy-5-phosphonomethyl-cyclohexanecarb...)
Affinity DataKi:  5.40nMAssay Description:Inhibition constant against 3-dehydroquinate synthaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2010
Entry Details Article