Reaction Details Report a problem with these data
Target
Metallo-beta-lactamase GIM-1
Ligand
BDBM367678
Substrate
n/a
Meas. Tech.
MBL Inhibitory Activity in Constructed E. coli Cells Expressing MBLs
IC50
400±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:
Metallo-beta-lactamase GIM-1
Synonyms:
GIM-1 | GIM-1 protein | Metallo-beta-lactamase GIM-1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
27418.35
Organism:
Pseudomonas aeruginosa
Description:
n/a
Residue:
250
Sequence:
MKNVLVFLILLVALPALAQGHKPLEVIKIEDGVYLHTSFKNIEGYGLVDSNGLVVLDNNQAYIIDTPWSEEDTKLLLSWATDRGYQVMASISTHSHEDRTAGIKLLNSKSIPTYTSELTKKLLAREGKPVPTHYFKDDEFTLGNGLIELYYPGAGHTEDNIVAWLPKSKILFGGCLVRSHEWEGLGYVGDASISSWADSIKNIVSKKYPIQMVVPGHGKVGSSDILDHTIDLAESASNKLMQPTAEASAD
  
Inhibitor
Name:
BDBM367678
Synonyms:
(R)-1-(((R)-1-((4-(2-(bis(pyridin-2-ylmethyl)amino)acetamido)phenethyl)amino)-1-oxopropan-2-yl)amino)-1-oxopropan-2-aminium chloride (OAA4033) | US10227327, Example 24
Type:
Small organic molecule
Emp. Form.:
C28H36N7O3
Mol. Mass.:
518.63
SMILES:
C[C@@H]([NH3+])C(=O)N[C@H](C)C(=O)NCCc1ccc(NC(=O)CN(Cc2ccccn2)Cc2ccccn2)cc1 |r|
Structure:
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