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Target
PA-I galactophilic lectin
Ligand
BDBM50591291
Substrate
n/a
Meas. Tech.
ChEMBL_2199748 (CHEMBL5112264)
IC50
29800±n/a nM
Citation
 Meiers, J; Rox, K; Titz, A Lectin-Targeted Prodrugs Activated by  J Med Chem 65:13988-14014 (2022) [PubMed] 
Target
Name:
PA-I galactophilic lectin
Synonyms:
Galactose-binding lectin | PA-I galactophilic lectin | PA-IL | PA1L_PSEAE | lecA | pa1L
Type:
PROTEIN
Mol. Mass.:
12891.24
Organism:
Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 / 1C / PRS 101 / LMG12228)
Description:
ChEMBL_109520
Residue:
122
Sequence:
MAWKGEVLANNEAGQVTSIIYNPGDVITIVAAGWASYGPTQKWGPQGDREHPDQGLICHDAFCGALVMKIGNSGTIPVNTGLFRWVAPNNVQGAITLIYNDVPGTYGNNSGSFSVNIGKDQS
  
Inhibitor
Name:
BDBM50591291
Synonyms:
CHEMBL5176709
Type:
Small organic molecule
Emp. Form.:
C44H56FN7O13S
Mol. Mass.:
942.018
SMILES:
CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)c1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)C(=O)N[C@@H](C)C(=O)N[C@H]1CCN(C1)c1cc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 |r|
Structure:
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