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4R93

BACE-1 in complex with (R)-4-(2-cyclohexylethyl)-1-methyl-5-oxo-4-(((1S,3R)-3-(3-phenylureido)cyclohexyl)methyl)imidazolidin-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
ALYS300
AHOH754
AHOH885
AHOH927
AHOH988
BHIS106
BPHE108
BASP167
BLYS168

site_idAC2
Number of Residues9
DetailsBINDING SITE FOR RESIDUE TLA A 502
ChainResidue
AARG68
AASN89
AHIS110
AARG111
AASN175
AHOH713
AHOH829
AHOH854
AHOH966

site_idAC3
Number of Residues15
DetailsBINDING SITE FOR RESIDUE 779 A 503
ChainResidue
AASP93
AGLY95
AVAL130
ATYR132
ALYS168
APHE169
APHE170
AILE171
AARG189
AASP289
AGLY291
ATHR292
AHOH912
AHOH980
AHOH999

site_idAC4
Number of Residues9
DetailsBINDING SITE FOR RESIDUE TLA B 501
ChainResidue
BARG68
BASN89
BHIS110
BARG111
BASN175
BHOH801
BHOH802
BHOH825
BHOH934

site_idAC5
Number of Residues14
DetailsBINDING SITE FOR RESIDUE 779 B 502
ChainResidue
BASP93
BGLY95
BVAL130
BTYR132
BLYS168
BPHE169
BPHE170
BILE171
BARG189
BASP289
BGLY291
BTHR292
BHOH923
BHOH1022

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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