Brand  (β version)

PDB ID: 2OHS

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Ligands
Code Name Style Show Link
9IP N~3~-[3-(5-methoxypyridin-3-yl)benzyl]pyridine-2,3-diamine PoSSuM
DMS Dimethyl sulfoxide PoSSuM
IOD Iodide ion PoSSuM
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Structure summary

Code : 2OHS   PDBj   RCSB PDB   PDBe
Header : HYDROLASE
Title : X-ray crystal structure of beta secretase complexed with compound 6b
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 ( 2.450 Å )
Citation :

Application of fragment screening by X-ray crystallography to the discovery of aminopyridines as inhibitors of beta-secretase.

Congreve, M.,Aharony, D.,Albert, J.  et al.
(2007)  J.Med.Chem.  50 : 1124 - 1132

PubMed: 17315857
DOI: 10.1021/jm061197u

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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