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Target
Alpha-galactosidase
Ligand
BDBM50236280
Substrate
n/a
Meas. Tech.
ChEMBL_1658945 (CHEMBL4008557)
Ki
>100000±n/a nM
Citation
 García-Moreno, MI; de la Mata, M; Sánchez-Fernández, EM; Benito, JM; Díaz-Quintana, A; Fustero, S; Nanba, E; Higaki, K; Sánchez-Alcázar, JA; García Fernández, JM; Ortiz Mellet, C Fluorinated Chaperone-ß-Cyclodextrin Formulations forß-Glucocerebrosidase Activity Enhancement in Neuronopathic Gaucher Disease. J Med Chem 60:1829-1842 (2017) [PubMed]  Article 
Target
Name:
Alpha-galactosidase
Synonyms:
α-galactosidase | AGAL_COFAR | Alpha-galactosidase
Type:
Protein
Mol. Mass.:
41306.82
Organism:
Coffea arabica (Coffee beans)
Description:
n/a
Residue:
378
Sequence:
MVKSPGTEDYTRRSLLANGLGLTPPMGWNSWNHFRCNLDEKLIRETADAMVSKGLAALGYKYINLDDCWAELNRDSQGNLVPKGSTFPSGIKALADYVHSKGLKLGIYSDAGTQTCSKTMPGSLGHEEQDAKTFASWGVDYLKYDNCNNNNISPKERYPIMSKALLNSGRSIFFSLCEWGEEDPATWAKEVGNSWRTTGDIDDSWSSMTSRADMNDKWASYAGPGGWNDPDMLEVGNGGMTTTEYRSHFSIWALAKAPLLIGCDIRSMDGATFQLLSNAEVIAVNQDKLGVQGNKVKTYGDLEVWAGPLSGKRVAVALWNRGSSTATITAYWSDVGLPSTAVVNARDLWAHSTEKSVKGQISAAVDAHDSKMYVLTPQ
  
Inhibitor
Name:
BDBM50236280
Synonyms:
CHEMBL4100971
Type:
Small organic molecule
Emp. Form.:
C20H24F13N3O5S
Mol. Mass.:
665.466
SMILES:
[H][C@@]12CO[C@@]([H])([C@H](O)[C@@H](O)[C@@H]1O)N2C(=S)NCCCCNC(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |r,TLB:7:6:2.3:12,THB:11:10:2.3:12|
Structure:
Search PDB for entries with ligand similarity: