BDBM152695 S02030

SMILES OB(O)[C@H](Cn1cc(nn1)C(O)=O)NC(=O)Cc1cccs1

InChI Key InChIKey=ZXGRTNOGXAKRBS-VIFPVBQESA-N

Data  1 KI  1 Kd  1 ITC

PDB links: 4 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 152695   

TargetBeta-lactamase [24-383](Acinetobacter baumannii (g-Proteobacteria))
Grand Valley State University

LigandPNGBDBM152695(S02030)
Show SMILES OB(O)[C@H](Cn1cc(nn1)C(O)=O)NC(=O)Cc1cccs1
Show InChI InChI=1S/C11H13BN4O5S/c17-10(4-7-2-1-3-22-7)13-9(12(20)21)6-16-5-8(11(18)19)14-15-16/h1-3,5,9,20-21H,4,6H2,(H,13,17)(H,18,19)/t9-/m0/s1
Affinity DataKi:  44.5nM ΔG°:  -10.0kcal/mole Kd:  590nMpH: 7.4 T: 2°CAssay Description:Steady state kinetics assays were performed on a Cary 100 UV−vis spectrophotometer in 10 mM phosphate-buffered saline (pH 7.4) with 2 nM ADC-7....More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 152695   

CellADC-7 beta-lactamase (ADC-7)(Acinetobacter baumannii (g-Proteobacteria))
Grand Valley State University

SyringePNGBDBM152695(S02030)
ITC DataΔG°: -8.50kcal/mole −TΔS°: 0.199kcal/mole ΔH°: -9.31kcal/mole logk: 1.73E+6
pH: 7.4 T: 25.00°C 
Syringe InfoPC cidPC sidPDB