2P4J
Crystal structure of beta-secretase bond to an inhibitor with Isophthalamide Derivatives at P2-P3
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, D (A, B, C, D) | Beta-secretase 1 | polymer | 389 | 43312.8 | 4 | UniProt (P56817) Pfam (PF00026) | Homo sapiens (human) | 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 |
| 2 | E, F, G, H (A, B, C, D) | N-[(1S,2S,4R)-2-HYDROXY-1-ISOBUTYL-5-({(1S)-1-[(ISOPROPYLAMINO)CARBONYL]-2-METHYLPROPYL}AMINO)-4-METHYL-5-OXOPENTYL]-5-[METHYL(METHYLSULFONYL)AMINO]-N'-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE | non-polymer | 701.9 | 4 | Chemie (23I) | |||
| 3 | I, J, K, L (A, B, C, D) | water | water | 18.0 | 438 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 173251.2 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 2807.7 | |
| All* | Total formula weight | 176058.9 |
