Reaction Details Report a problem with these data
Target
Beta-lactamase
Ligand
BDBM98782
Substrate
BDBM98856
Meas. Tech.
Spectrophotometric Assay
IC50
22±0.0 nM
Citation
Blizzard, TA; Chen, H; Gude, C; Hermes, JD; Imbriglio, J; Kim, S; Wu, JY; Mortko, CJ; Mangion, I; Rivera, N; Ruck, RT; Shevlin, M Beta-lactamase inhibitors US Patent US8487093 Publication Date 7/16/2013
More Info.:
Target
Name:
Beta-lactamase
Synonyms:
Beta-lactamase (AmpC)
Type:
Enzyme
Mol. Mass.:
43489.98
Organism:
Pseudomonas aeruginosa
Description:
Q3LG62
Residue:
397
Sequence:
MRDTRFPCLCGIAASTLLFATTPAIADEAPADRLKALVDAAVQPVMKANDIPGLAVAISLKGEPHYFSYGLASKEDGRRVTPETLFEIGSVSKTFTVTLAGYALAQDKMRLDDRASQHWPALQGSRFDGISLLDLATYTAGGLPLQFPDSVQKDQAQIRDYYRQWQPTYAPGSQRLYSNPSIGLFGYLAARSLGQPFERLMEQQLFPALGLEQTHLDVPEAALAQYAQGYGKDDRPLRVGPGPLDAEGYGVKTSAADLLRFVDANLHPERLDRPWAQALDATHRGYYKVGDMTQGLGWEAYDWPISLKRLQAGNSTPMALQPHRIARLPAPQALEGQRLLNKTGSTNGFGAYVAFVPGRDLGLVILANRNYPNAERVKIAYAILSGLEQQAKVPLKR
Inhibitor
Name:
BDBM98782
Synonyms:
US8487093, 162
Type:
Small organic molecule
Emp. Form.:
C18H24N4O6S
Mol. Mass.:
424.471
SMILES:
OS(=O)(=O)ON1[C@H]2CN([C@@H](CC2)C(=O)Nc2ccc(CN3CCCC3)cc2)C1=O |r|