3H0B
Discovery of aminoheterocycles as a novel beta-secretase inhibitor class
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 | 405 | 45238.9 | 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 | 4-[(1S)-1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-nitrophenyl)ethyl]-1H-imidazol-2-amine | non-polymer | 386.4 | 3 | Chemie (B35) | |||
| 3 | water | water | 18.0 | 172 | Chemie (HOH) |
Sequence modifications
A, B, C: 430 - 385 (UniProt: P56817)
| PDB | External Database | Details |
|---|---|---|
| Met 429 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 135716.7 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 1159.1 | |
| All* | Total formula weight | 136875.8 |
