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TargetBeta-secretase (BACE)
LigandBDBM26505
Substrate/CompetitorFluorescent Substrate
Meas. Tech.Enzyme Inhibition Assay
pH4.5±n/a
Temperature295.15±n/a K
IC50 120±n/a nM
Citation Beswick PCharrier NClarke BDemont EDingwall CDunsdon RFaller AGleave RHawkins JHussain IJohnson CNMacPherson DMaile GMatico RMilner PMosley JNaylor AO'Brien ARedshaw SRiddell DRowland PSkidmore JSoleil VSmith KJStanway SStemp GStuart ASweitzer STheobald PVesey DWalter DSWard JWayne G BACE-1 inhibitors part 3: identification of hydroxy ethylamines (HEAs) with nanomolar potency in cells. Bioorg Med Chem Lett 18:1022-6 (2008) [PubMed]  Article
More Info.:Get all data from this article,   Solution Info,  Assay Method
 
Beta-secretase (BACE)
Name:Beta-secretase (BACE)
Synonyms:Aspartyl protease 2 | BACE1 | Beta-secretase 1 | Beta-secretase 1 (BACE 1) | Beta-secretase 1 (BACE-1) | Beta-secretase 1 (BACE1) | Beta-site amyloid precursor protein cleaving enzyme 1 | Memapsin-2 | beta-Secretase (BACE-1) | beta-Secretase (BACE1)
Type:Protein
Mol. Mass.:55701.04
Organism:Homo sapiens (Human)
Description:P56817
Residue:501
Sequence:
MAQALPWLLLWMGAGVLPAHGTQHGIRLPLRSGLGGAPLGLRLPRETDEEPEEPGRRGSF
VEMVDNLRGKSGQGYYVEMTVGSPPQTLNILVDTGSSNFAVGAAPHPFLHRYYQRQLSST
YRDLRKGVYVPYTQGKWEGELGTDLVSIPHGPNVTVRANIAAITESDKFFINGSNWEGIL
GLAYAEIARPDDSLEPFFDSLVKQTHVPNLFSLQLCGAGFPLNQSEVLASVGGSMIIGGI
DHSLYTGSLWYTPIRREWYYEVIIVRVEINGQDLKMDCKEYNYDKSIVDSGTTNLRLPKK
VFEAAVKSIKAASSTEKFPDGFWLGEQLVCWQAGTTPWNIFPVISLYLMGEVTNQSFRIT
ILPQQYLRPVEDVATSQDDCYKFAISQSSTGTVMGAVIMEGFYVVFDRARKRIGFAVSAC
HVHDEFRTAAVEGPFVTLDMEDCGYNIPQTDESTLMTIAYVMAAICALFMLPLCLMVCQW
CCLRCLRQQHDDFADDISLLK
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM26505
NameBDBM26505
Synonyms:BMCL181022 Compound 12 | N-[(2S,3R)-4-(benzylamino)-3-hydroxy-1-phenylbutan-2-yl]-3-(1,1-dioxo-1,2-thiazinan-2-yl)-5-(ethylamino)benzamide | sultam hydroxyethylamine (HEA) derivative, 9b
TypeSmall organic molecule
Emp. Form.C30H38N4O4S
Mol. Mass.550.712
SMILESCCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1ccccc1)N1CCCCS1(=O)=O |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
Fluorescent Substrate
Name:Fluorescent Substrate
Synonyms:n/a
Type:Peptide
Mol. Mass.:2030.30
Organism:n/a
Description:n/a
Residue:18
Sequence:
FAM-SEVNLDAEFK-TAMRA