6E3Z
Structure of Bace-1 in complex with Ligand 8
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 | 432 | 48111.1 | 3 | UniProt (P56817) Pfam (PF00026) In PDB | Homo sapiens (Human) | Aspartyl protease 2,Asp 2,Beta-site amyloid precursor protein cleaving enzyme 1,Beta-site APP cleaving enzyme 1,Memapsin-2,Membrane-associated aspartic protease 2 |
2 | A, B, C | N-{3-[(2R,3R)-5-amino-3-methyl-2-(trifluoromethyl)-3,6-dihydro-2H-1,4-oxazin-3-yl]-4-fluorophenyl}-3,5-dichloropyridine-2-carboxamide | non-polymer | 465.2 | 4 | Chemie (HRV) | |||
3 | water | water | 18.0 | 820 | Chemie (HOH) |
Sequence modifications
A, B, C: -39 - 385 (UniProt: P56817)
PDB | External Database | Details |
---|---|---|
Met -46 | - | expression tag |
His -45 | - | expression tag |
His -44 | - | expression tag |
His -43 | - | expression tag |
His -42 | - | expression tag |
His -41 | - | expression tag |
His -40 | - | expression tag |
Thr -5 | Arg 56 | conflict |
Thr -4 | Arg 57 | conflict |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 3 |
Total formula weight | 144333.4 | |
Non-Polymers* | Number of molecules | 4 |
Total formula weight | 1860.9 | |
All* | Total formula weight | 146194.3 |