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4DPI

BACE-1 in complex with HEA-macrocyclic inhibitor, MV078512

Functional Information from GO Data
ChainGOidnamespacecontents
A0004190molecular_functionaspartic-type endopeptidase activity
A0006508biological_processproteolysis
A0016020cellular_componentmembrane
Functional Information from PDB Data
site_idAC1
Number of Residues23
DetailsBINDING SITE FOR RESIDUE 0N1 A 501
ChainResidue
AGLY59
ATYR119
ATHR120
AGLN121
AILE158
AARG176
ATYR246
AASP276
ASER277
AGLY278
ATHR279
AGLN60
ATHR280
AARG283
AALA383
AHOH624
AGLY61
ALEU78
AASP80
AGLY82
ASER83
AVAL117
APRO118

Functional Information from PROSITE/UniProt
site_idPS00141
Number of Residues12
DetailsASP_PROTEASE Eukaryotic and viral aspartyl proteases active site. ILVDTGSSNFAV
ChainResidueDetails
AILE77-VAL88

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: ACT_SITE => ECO:0000255|PROSITE-ProRule:PRU10094
ChainResidueDetails
AASP80
AASP276

site_idSWS_FT_FI2
Number of Residues7
DetailsMOD_RES: N6-acetyllysine => ECO:0000269|PubMed:17425515, ECO:0000269|PubMed:19011241
ChainResidueDetails
ALYS113
ALYS262
ALYS266
ALYS272
ALYS286
ALYS287
ALYS294

site_idSWS_FT_FI3
Number of Residues4
DetailsCARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000255
ChainResidueDetails
AASN140
AASN159
AASN210
AASN341

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PDB entries from 2024-07-10

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