4BFD
CRYSTAL STRUCTURE OF BACE-1 IN COMPLEX WITH CHEMICAL LIGAND
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | BETA-SECRETASE 1 | polymer | 409 | 45554.0 | 1 | UniProt (P56817) Pfam (PF00026) In PDB | HOMO SAPIENS (HUMAN) | ASPARTYL PROTEASE 2, ASP2, ASP 2, BETA-SITE AMYLOID PRECURSOR PROTEIN CLEAVING ENZYME 1, BETA-SITE APP CLEAVING ENZYME 1, MEMAPSIN-2, MEMBRANE-ASSOCIATED ASPARTIC PROTEASE 2, BETA-SECRETASE |
2 | A | N-[3-[(1S,3S,6S)-5-azanyl-3-methyl-4-azabicyclo[4.1.0]hept-4-en-3-yl]-4-fluoranyl-phenyl]-5-chloranyl-pyridine-2-carbox amide | non-polymer | 372.8 | 1 | Chemie (8T3) | |||
3 | A | SODIUM ION | non-polymer | 23.0 | 2 | Chemie (NA) | |||
4 | A | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 1 | Chemie (DMS) | |||
5 | water | water | 18.0 | 317 | Chemie (HOH) |
Sequence modifications
A: 46 - 454 (UniProt: P56817)
PDB | External Database | Details |
---|---|---|
Ala 307 | Lys 307 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 45554.0 | |
Non-Polymers* | Number of molecules | 4 |
Total formula weight | 496.9 | |
All* | Total formula weight | 46050.9 |