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2VNM

Human BACE-1 in complex with 3-(1,1-dioxidotetrahydro-2H-1,2-thiazin- 2-yl)-5-(ethylamino)-N-((1S,2R)-2-hydroxy-1-(phenylmethyl)-3-(((3-(trifluoromethyl)phenyl)methyl)amino)propyl)benzamide

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1ABETA-SECRETASE 1polymer39243761.31UniProt (P56817)
Pfam (PF00026)
In PDB
HOMO SAPIENS (HUMAN)BACE-1, BETA-SITE APP CLEAVING ENZYME 1, BETA-SITE AMYLOID PRECURSOR PROTEIN CLEAVING ENZYME 1, MEMBRANE-ASSOCIATED ASPARTIC PROTEASE 2, MEMAPSIN-2, ASPARTYL PROTEASE 2, ASP 2, ASP2
2AN-[(1S,2R)-1-benzyl-2-hydroxy-3-{[3-(trifluoromethyl)benzyl]amino}propyl]-3-(1,1-dioxido-1,2-thiazinan-2-yl)-5-(ethylamino)benzamidenon-polymer618.72Chemie (CM8)
3waterwater18.0366Chemie (HOH)
Sequence modifications
A: 61 - 452 (UniProt: P56817)
PDBExternal DatabaseDetails
Gln 153Asn 153engineered mutation
Gln 172Asn 172engineered mutation
Gln 223Asn 223engineered mutation
Gln 354Asn 354engineered mutation
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains1
Total formula weight43761.3
Non-Polymers*Number of molecules2
Total formula weight1237.4
All*Total formula weight44998.7
*Water molecules are not included.

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數據於2024-09-18公開中

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