BDBM11941 2,5-ADP::ADENOSINE-2 -5 -DIPHOSPHATE::{[(2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxy-4-(phosphonooxy)oxolan-2-yl]methoxy}phosphonic acid
SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1OP(O)(O)=O
InChI Key InChIKey=AEOBEOJCBAYXBA-KQYNXXCUSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 1 hit for monomerid = 11941
Target2-dehydropantoate 2-reductase(Escherichia coli (strain K12))
University Chemical Laboratory
Curated by ChEMBL
University Chemical Laboratory
Curated by ChEMBL
Affinity DataKi: 2.40E+5nMAssay Description:Inhibition of Escherichia coli KPRMore data for this Ligand-Target Pair
Activity Spreadsheet -- ITC Data from BindingDB
Found 2 hits for monomerid = 11941
ITC DataΔG°: -9.78kcal/mole −TΔS°: 8.18kcal/mole ΔH°: -18.0kcal/mole logk: 1.90E+7
pH: 7.0 T: 25.00°C
pH: 7.0 T: 25.00°C
ITC DataΔG°: -10.3kcal/mole −TΔS°: 9.19kcal/mole ΔH°: -19.0kcal/mole logk: 2.80E+7
pH: 7.0 T: 25.00°C
pH: 7.0 T: 25.00°C