3I25
Potent Beta-Secretase 1 hydroxyethylene Inhibitor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C | Beta-secretase 1 | polymer | 406 | 45396.1 | 3 | UniProt (P56817) Pfam (PF00026) In PDB | Homo sapiens (human) | Beta-site amyloid precursor protein cleaving enzyme 1, Beta-site APP cleaving enzyme 1, Membrane-associated aspartic protease 2, Memapsin-2, Aspartyl protease 2, Asp 2, ASP2 |
| 2 | A, B, C | N-[(2S,3S,5R)-1-(3,5-difluorophenoxy)-3-hydroxy-5-(2-methoxyethoxy)-6-[[(2S)-3-methyl-1-oxo-1-(phenylmethylamino)butan-2-yl]amino]-6-oxo-hexan-2-yl]-5-(methyl-methylsulfonyl-amino)-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide | non-polymer | 896.0 | 3 | Chemie (MV7) | |||
| 3 | water | water | 18.0 | 194 | Chemie (HOH) |
Sequence modifications
A, B, C: 29 - 385 (UniProt: P56817)
| PDB | External Database | Details |
|---|---|---|
| Met 28 | - | initiating methionine |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 136188.2 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 2688.0 | |
| All* | Total formula weight | 138876.3 |
