Reaction Details Report a problem with these data
Target
Fucose-binding lectin PA-IIL
Ligand
BDBM50591434
Substrate
n/a
Meas. Tech.
ChEMBL_2200361 (CHEMBL5112877)
IC50
138±n/a nM
Citation
 Ma?a, P; Siebs, E; Meiers, J; Rox, K; Varrot, A; Imberty, A; Titz, A Discovery of  J Med Chem 65:14180-14200 (2022) [PubMed] 
Target
Name:
Fucose-binding lectin PA-IIL
Synonyms:
LecB | PA-IIL
Type:
Protein
Mol. Mass.:
11857.84
Organism:
Pseudomonas aeruginosa
Description:
Q9HYN5
Residue:
115
Sequence:
MATQGVFTLPANTRFGVTAFANSSGTQTVNVLVNNETAATFSGQSTNNAVIGTQVLNSGSSGKVQVQVSVNGRPSDLVSAQVILTNELNFALVGSEDGTDNDYNDAVVVINWPLG
  
Inhibitor
Name:
BDBM50591434
Synonyms:
CHEMBL5208230
Type:
Small organic molecule
Emp. Form.:
C14H19NO6
Mol. Mass.:
297.3038
SMILES:
COc1ccc(cc1)C(=O)N[C@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Structure:
Search PDB for entries with ligand similarity: