Reaction Details Report a problem with these data
Target
VIM-2 type metallo-beta-lactamase
Ligand
BDBM367683
Substrate
n/a
Meas. Tech.
MBL Inhibitory Activity in Constructed E. coli Cells Expressing MBLs
IC50
19030±n/a nM
Citation
 Rongved, P; Åstrand, OA; Bayer, A; Leiros, HS; Samuelsen, null; Edvardsen, KS; Muhammad, Z Inhibitors of metallo-beta-lactamase (MBL) comprising a zinc chelating moiety US Patent  US10227327 Publication Date 3/12/2019 
Target
Name:
VIM-2 type metallo-beta-lactamase
Synonyms:
VIM-2
Type:
Enzyme Catalytic Domain
Mol. Mass.:
28318.00
Organism:
Pseudomonas aeruginosa
Description:
n/a
Residue:
266
Sequence:
MFKLLSKLLVYLTASIMAIASPLAFSVDSSGEYPTVSEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRAAGVATYASPSTRRLAEVEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSASVLYGGCAIYELSRTSAGNVADADLAEWPTSIERIQQHYPEAQFVIPGHGLPGGLDLLKHTTNVVKAHTNRSVVE
  
Inhibitor
Name:
BDBM367683
Synonyms:
1-(1-β-bromo-4-methoxybenzyl)-1H-1,2,3-triazol-4-yl)-N,N-bis(pyridin-2-ylmethyl)methanamine (OAA4077) | US10227327, Example 9
Type:
Small organic molecule
Emp. Form.:
C23H23BrN6O
Mol. Mass.:
479.372
SMILES:
COc1ccc(Cn2cc(CN(Cc3ccccn3)Cc3ccccn3)nn2)cc1Br
Structure:
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