Reaction Details Report a problem with these data
Target
Pancreatic alpha-amylase
Ligand
BDBM163656
Substrate
n/a
Meas. Tech.
Kinetic Studies
Temperature
303.15±0 K
Ki
1.39e+4± 1.8e+3 nM
Citation
 Williams, LK; Zhang, X; Caner, S; Tysoe, C; Nguyen, NT; Wicki, J; Williams, DE; Coleman, J; McNeill, JH; Yuen, V; Andersen, RJ; Withers, SG; Brayer, GD The amylase inhibitor montbretin A reveals a new glycosidase inhibition motif. Nat Chem Biol 11:691-6 (2015) [PubMed]  Article 
Target
Name:
Pancreatic alpha-amylase
Synonyms:
1,4-alpha-D-glucan glucanohydrolase | AMY2A | AMYP_HUMAN | PA | Pancreatic α-amylase (HPA) | Pancreatic alpha-amylase | Pancreatic alpha-amylase (HPA)
Type:
Protein
Mol. Mass.:
57709.71
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
511
Sequence:
MKFFLLLFTIGFCWAQYSPNTQQGRTSIVHLFEWRWVDIALECERYLAPKGFGGVQVSPPNENVAIYNPFRPWWERYQPVSYKLCTRSGNEDEFRNMVTRCNNVGVRIYVDAVINHMCGNAVSAGTSSTCGSYFNPGSRDFPAVPYSGWDFNDGKCKTGSGDIENYNDATQVRDCRLTGLLDLALEKDYVRSKIAEYMNHLIDIGVAGFRLDASKHMWPGDIKAILDKLHNLNSNWFPAGSKPFIYQEVIDLGGEPIKSSDYFGNGRVTEFKYGAKLGTVIRKWNGEKMSYLKNWGEGWGFVPSDRALVFVDNHDNQRGHGAGGASILTFWDARLYKMAVGFMLAHPYGFTRVMSSYRWPRQFQNGNDVNDWVGPPNNNGVIKEVTINPDTTCGNDWVCEHRWRQIRNMVIFRNVVDGQPFTNWYDNGSNQVAFGRGNRGFIVFNNDDWSFSLTLQTGLPAGTYCDVISGDKINGNCTGIKIYVSDDGKAHFSISNSAEDPFIAIHAESKL
  
Inhibitor
Name:
BDBM163656
Synonyms:
3-O-(6-(4-(Caffeamidomethyl)-triazolyl)hexyl)quercetin (Compound 10) | mini-MbA analog inhibitor 10
Type:
Small organic molecule
Emp. Form.:
C33H32N4O10
Mol. Mass.:
644.628
SMILES:
Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(OCCCCCCn1cc(CNC(=O)\C=C\c3ccc(O)c(O)c3)nn1)c2=O
Structure:
Search PDB for entries with ligand similarity: