Brand  (β version)

PDB ID: 3L58

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Ligands
Code Name Style Show Link
CS5 N'-{(1s,2r)-1-(3,5-difluorobenzyl)-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl}-5-methyl-N,N-dipropylisophthalamide PoSSuM
Non-standard Residues
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Structure summary

Code : 3L58   PDBj   RCSB PDB   PDBe
Header : HYDROLASE
Title : Structure of BACE Bound to SCH589432
Release Data : 2010-02-16
Compound :
mol_id molecule chains synonym
1 Beta-secretase 1 A,B Beta-site amyloid precursor protein cleaving enzyme 1, Beta-site APP cleaving enzyme 1, Membrane-associated aspartic protease 2, Memapsin-2, Aspartyl protease 2, Asp 2, ASP2
ec: 3.4.23.46
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli  (taxid:562)
gene: BACE, BACE1, KIAA1149
expression_system_strain: BL21(DE3)
expression_system_vector_type: pET11a
Authors : Strickland, C., Zhu, Z.
Keywords : BACE1, Alzheimers, Alternative splicing, Aspartyl protease, Disulfide bond, Endoplasmic reticulum, Endosome, Glycoprotein, Golgi apparatus, Hydrolase, Membrane, Polymorphism, Protease, Transmembrane, Zymogen
Exp. method : X-RAY DIFFRACTION ( 1.800 Å )
Citation :

Discovery of Cyclic Acylguanidines as Highly Potent and Selective beta-Site Amyloid Cleaving Enzyme (BACE) Inhibitors: Part I-Inhibitor Design and Validation

Zhu, Z.,Sun, Z.Y.,Ye, Y.  et al.
(2010)  J.Med.Chem.  53 : 951 - 965

PubMed: 20043696
DOI: 10.1021/jm901408p

Reaction

Chain : A, B
UniProt : P56817 (BACE1_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
Broad endopeptidase specificity. Cleaves Glu-Val-Asn-Leu-|- Asp-Ala-Glu-Phe in the Swedish variant of Alzheimer's amyloid precursor protein. 3.4.23.46 PubMed:10677483
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