Brand  (β version)

PDB ID: 2OF0

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Ligands
Code Name Style Show Link
CMZ (2s)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ylpropan-2-ol PoSSuM
DMS Dimethyl sulfoxide PoSSuM
IOD Iodide ion PoSSuM
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Structure summary

Code : 2OF0   PDBj   RCSB PDB   PDBe
Header : HYDROLASE
Title : X-ray crystal structure of beta secretase complexed with compound 5
Release Data : 2007-03-13
Compound :
mol_id molecule chains synonym
1 Beta-secretase 1 A Beta-site APP cleaving enzyme 1, Beta-site amyloid precursor protein cleaving enzyme 1, Membrane-associated aspartic protease 2, Memapsin-2, Aspartyl protease 2, Asp 2, ASP2
ec: 3.4.23.46
fragment: protease domain
mutation: R56K, R57K
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli BL21(DE3)  (taxid:469008)
gene: BACE1, BACE
expression_system_strain: BL21(DE3)
expression_system_vector_type: Plasmid
expression_system_plasmid: pET
Authors : Patel, S.
Keywords : ALTERNATIVE SPLICING, ALZHEIMER'S DISEASE, ASPARTIC PROTEASE, ASPARTYL PROTEASE, BASE, BETA-SECRETASE, GLYCOPROTEIN, HYDROLASE, MEMAPSIN 2, TRANSMEMBRANE, ZYMOGEN
Exp. method : X-RAY DIFFRACTION ( 2.250 Å )
Citation :

Application of fragment screening by X-ray crystallography to beta-Secretase.

Murray, C.W.,Callaghan, O.,Chessari, G.  et al.
(2007)  J.Med.Chem.  50 : 1116 - 1123

PubMed: 17315856
DOI: 10.1021/jm0611962

Reaction

Chain : A
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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