Target
Beta-N-acetylhexosaminidase
Ligand
BDBM50327038
Substrate
n/a
Meas. Tech.
ChEMBL_479697 (CHEMBL933561)
Ki
20000±n/a nM
Citation
 Amorelli, BYang, CRempel, BWithers, SGKnapp, S N-Acetylhexosaminidase inhibitory properties of C-1 homologated GlcNAc- and GalNAc-thiazolines. Bioorg Med Chem Lett 18:2944-7 (2008) [PubMed]  Article 
Target
Name:
Beta-N-acetylhexosaminidase
Synonyms:
B-N-acetylhexosaminidase
Type:
PROTEIN
Mol. Mass.:
55190.87
Organism:
Streptomyces plicatus
Description:
ChEMBL_479697
Residue:
506
Sequence:
MTTGAAPDRKAPVRPTPLDRVIPAPASVDPGGAPYRITRGTHIRVDDSREARRVGDYLADLLRPATGYRLPVTAHGHGGIRLRLAGGPYGDEGYRLDSGPAGVTITARKAAGLFHGVQTLRQLLPPAVEKDSAQPGPWLVAGGTIEDTPRYAWRSAMLDVSRHFFGVDEVKRYIDRVARYKYNKLHLHLSDDQGWRIAIDSWPRLATYGGSTEVGGGPGGYYTKAEYKEIVRYAASRHLEVVPEIDMPGHTNAALASYAELNCDGVAPPLYTGTKVGFSSLCVDKDVTYDFVDDVIGELAALTPGRYLHIGGDEAHSTPKADFVAFMKRVQPIVAKYGKTVVGWHQLAGAEPVEGALVQYWGLDRTGDAEKAEVAEAARNGTGLILSPADRTYLDMKYTKDTPLGLSWAGYVEVQRSYDWDPAGYLPGAPADAVRGVEAPLWTETLSDPDQLDYMAFPRLPGVAELGWSPASTHDWDTYKVRLAAQAPYWEAAGIDFYRSPQVPWT
  
Inhibitor
Name:
BDBM50327038
Synonyms:
(3aR,5R,6S,7R,7aR)-5-(hydroxymethyl)-2-methyl-5,6,7,7a-tetrahydro-3aH-pyrano[3,2-d]thiazole-6,7-diol | (3aR,5R,6S,7R,7aR)-5-(hydroxymethyl)-2-methyl-5,6,7,7a-tetrahydropyrano[3,2-d]thiazole-6,7-diol | 3AR,5R,6S,7R,7AR-5-HYDROXYMETHYL-2-METHYL-5,6,7,7A-TETRAHYDRO-3AH-PYRANO[3,2-D]THIAZOLE-6,7-DIOL | CHEMBL257158 | N-acetylglucosamine thiazoline
Type:
Small organic molecule
Emp. Form.:
C8H13NO4S
Mol. Mass.:
219.258
SMILES:
CC1=N[C@H]2[C@H](O[C@H](CO)[C@@H](O)[C@@H]2O)S1 |r,t:1|
Structure:
Search PDB for entries with ligand similarity: