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6NV9

BACE1 in complex with a macrocyclic inhibitor

Functional Information from GO Data
ChainGOidnamespacecontents
A0004190molecular_functionaspartic-type endopeptidase activity
A0006508biological_processproteolysis
A0016020cellular_componentmembrane
B0004190molecular_functionaspartic-type endopeptidase activity
B0006508biological_processproteolysis
B0016020cellular_componentmembrane
C0004190molecular_functionaspartic-type endopeptidase activity
C0006508biological_processproteolysis
C0016020cellular_componentmembrane
Functional Information from PDB Data
site_idAC1
Number of Residues20
Detailsbinding site for residue L3M A 401
ChainResidue
AGLY11
AGLN73
APHE108
ALYS224
AASP228
AGLY230
ATHR231
ATHR232
AASN233
AARG235
ASER325
AGLN12
AHOH577
AGLY13
ALEU30
AASP32
AGLY34
APRO70
ATYR71
ATHR72

site_idAC2
Number of Residues5
Detailsbinding site for residue SO4 A 402
ChainResidue
AARG96
AASN98
AGLU134
ASER139
AGLN143

site_idAC3
Number of Residues18
Detailsbinding site for residue L3M B 401
ChainResidue
BGLY11
BLEU30
BASP32
BGLY34
BPRO70
BTYR71
BTHR72
BGLN73
BLYS224
BILE226
BASP228
BGLY230
BTHR231
BTHR232
BASN233
BARG235
BSER325
BHOH549

site_idAC4
Number of Residues2
Detailsbinding site for residue SO4 B 402
ChainResidue
BARG61
BHOH503

site_idAC5
Number of Residues18
Detailsbinding site for residue L3M C 401
ChainResidue
CGLY11
CLEU30
CASP32
CGLY34
CPRO70
CTYR71
CTHR72
CGLN73
CLYS224
CASP228
CGLY230
CTHR231
CTHR232
CASN233
CARG235
CSER325
CTHR329
CHOH557

site_idAC6
Number of Residues5
Detailsbinding site for residue SO4 C 402
ChainResidue
CARG96
CALA97
CASN98
CSER139
CGLN143

Functional Information from PROSITE/UniProt
site_idPS00141
Number of Residues12
DetailsASP_PROTEASE Eukaryotic and viral aspartyl proteases active site. ILVDTGSSNFAV
ChainResidueDetails
AILE29-VAL40

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues6
DetailsACT_SITE: ACT_SITE => ECO:0000255|PROSITE-ProRule:PRU10094
ChainResidueDetails
AASP32
AASP228
BASP32
BASP228
CASP32
CASP228

site_idSWS_FT_FI2
Number of Residues21
DetailsMOD_RES: N6-acetyllysine => ECO:0000269|PubMed:17425515, ECO:0000269|PubMed:19011241
ChainResidueDetails
ALYS65
BLYS218
BLYS224
BLYS238
BLYS239
BLYS246
CLYS65
CLYS214
CLYS218
CLYS224
CLYS238
ALYS214
CLYS239
CLYS246
ALYS218
ALYS224
ALYS238
ALYS239
ALYS246
BLYS65
BLYS214

site_idSWS_FT_FI3
Number of Residues12
DetailsCARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000255
ChainResidueDetails
AASN92
CASN111
CASN162
CASN293
AASN111
AASN162
AASN293
BASN92
BASN111
BASN162
BASN293
CASN92

218853

PDB entries from 2024-04-24

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