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4R91

BACE-1 in complex with (R)-4-(2-cyclohexylethyl)-4-(((1S,3R)-3-(cyclopentylamino)cyclohexyl)methyl)-1-methyl-5-oxoimidazolidin-2-iminium

Functional Information from GO Data
ChainGOidnamespacecontents
A0004190molecular_functionaspartic-type endopeptidase activity
A0006508biological_processproteolysis
A0016020cellular_componentmembrane
B0004190molecular_functionaspartic-type endopeptidase activity
B0006508biological_processproteolysis
B0016020cellular_componentmembrane
Functional Information from PDB Data
site_idAC1
Number of Residues9
DetailsBINDING SITE FOR RESIDUE TLA A 501
ChainResidue
AARG68
AASN89
AHIS110
AARG111
AASN175
AHOH713
AHOH830
AHOH855
AHOH973

site_idAC2
Number of Residues10
DetailsBINDING SITE FOR RESIDUE 3KT A 502
ChainResidue
AASP93
AGLY95
ATYR132
APHE169
AASP289
AGLY291
ATHR292
ATHR293
AHOH990
AHOH998

site_idAC3
Number of Residues9
DetailsBINDING SITE FOR RESIDUE TLA B 501
ChainResidue
BARG68
BASN89
BHIS110
BARG111
BASN175
BHOH798
BHOH799
BHOH821
BHOH925

site_idAC4
Number of Residues15
DetailsBINDING SITE FOR RESIDUE 3KT B 502
ChainResidue
BGLY72
BGLN73
BGLY74
BASP93
BGLY95
BVAL130
BTYR132
BPHE169
BARG189
BTYR259
BASP289
BGLY291
BTHR292
BTHR293
BHOH1003

Functional Information from PROSITE/UniProt
site_idPS00141
Number of Residues12
DetailsASP_PROTEASE Eukaryotic and viral aspartyl proteases active site. ILVDTGSSNFAV
ChainResidueDetails
AILE90-VAL101

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsActive site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU10094","evidenceCode":"ECO:0000255"}]}
ChainResidueDetails

site_idSWS_FT_FI2
Number of Residues14
DetailsModified residue: {"description":"N6-acetyllysine","evidences":[{"source":"PubMed","id":"17425515","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"19011241","evidenceCode":"ECO:0000269"}]}
ChainResidueDetails

site_idSWS_FT_FI3
Number of Residues8
DetailsGlycosylation: {"description":"N-linked (GlcNAc...) asparagine","evidences":[{"evidenceCode":"ECO:0000255"}]}
ChainResidueDetails

246704

PDB entries from 2025-12-24

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