3S7L

Pyrazolyl and Thienyl Aminohydantoins as Potent BACE1 Inhibitors

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004190	molecular_function	aspartic-type endopeptidase activity
A	0006508	biological_process	proteolysis
A	0016020	cellular_component	membrane

Functional Information from PDB Data

site_id	AC1
Number of Residues	15
Details	BINDING SITE FOR RESIDUE 591 A 1

Chain	Residue
A	HOH27
A	GLN135
A	ILE172
A	ASP290
A	GLY292
A	THR293
A	HOH565
A	HOH39
A	GLY73
A	GLN74
A	GLY75
A	ASP94
A	GLY96
A	SER97
A	TYR133

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Functional Information from PROSITE/UniProt

site_id	PS00141
Number of Residues	12
Details	ASP_PROTEASE Eukaryotic and viral aspartyl proteases active site. ILVDTGSSNFAV

Chain	Residue	Details
A	ILE91-VAL102

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Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	2
Details	ACT_SITE: ACT_SITE => ECO:0000255|PROSITE-ProRule:PRU10094

Chain	Residue	Details
A	ASP94
A	ASP290

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site_id	SWS_FT_FI2
Number of Residues	7
Details	MOD_RES: N6-acetyllysine => ECO:0000269|PubMed:17425515, ECO:0000269|PubMed:19011241

Chain	Residue	Details
A	LYS127
A	LYS276
A	LYS280
A	LYS286
A	LYS300
A	LYS301
A	LYS308

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site_id	SWS_FT_FI3
Number of Residues	4
Details	CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000255

Chain	Residue	Details
A	ASN154
A	ASN173
A	ASN224
A	ASN355

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