Reaction Details Report a problem with these data
Target
Beta-xylosidase
Ligand
BDBM50182802
Substrate
n/a
Meas. Tech.
ChEMBL_344328 (CHEMBL868410)
Ki
7600±n/a nM
Citation
 Greimel, P; Häusler, H; Lundt, I; Rupitz, K; Stütz, AE; Tarling, CA; Withers, SG; Wrodnigg, TM Fluorescent glycosidase inhibiting 1,5-dideoxy-1,5-iminoalditols. Bioorg Med Chem Lett 16:2067-70 (2006) [PubMed]  Article 
Target
Name:
Beta-xylosidase
Synonyms:
XYNB_THESA | xynB
Type:
PROTEIN
Mol. Mass.:
58590.52
Organism:
Thermoanaerobacter saccharolyticum
Description:
ChEMBL_344328
Residue:
500
Sequence:
MIKVRVPDFSDKKFSDRWRYCVGTGRLGLALQKEYIETLKYVKENIDFKYIRGHGLLCDDVGIYREDVVGDEVKPFYNFTYIDRIFDSFLEIGIRPFVEIGFMPKKLASGTQTVFYWEGNVTPPKDYEKWSDLVKAVLHHFISRYGIEEVLKWPFEIWNEPNLKEFWKDADEKEYFKLYKVTAKAIKEVNENLKVGGPAICGGADYWIEDFLNFCYEENVPVDFVSRHATTSKQGEYTPHLIYQEIMPSEYMLNEFKTVREIIKNSHFPNLPFHITEYNTSYSPQNPVHDTPFNAAYIARILSEGGDYVDSFSYWTFSDVFEERDVPRSQFHGGFGLVALNMIPKPTFYTFKFFNAMGEEMLYRDEHMLVTRRDDGSVALIAWNEVMDKTENPDEDYEVEIPVRFRDVFIKRQLIDEEHGNPWGTWIHMGRPRYPSKEQVNTLREVAKPEIMTSQPVANDGYLNLKFKLGKNAVVLYELTERIDESSTYIGLDDSKINGY
  
Inhibitor
Name:
BDBM50182802
Synonyms:
5-(dimethylamino)-N-(6-((3R,4r,5S)-3,4,5-trihydroxypiperidin-1-yl)hexyl)naphthalene-1-sulfonamide | CHEMBL206358
Type:
Small organic molecule
Emp. Form.:
C23H35N3O5S
Mol. Mass.:
465.606
SMILES:
CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)C1
Structure:
Search PDB for entries with ligand similarity: