4FM7
Crystal Structure of BACE with Compound 14g
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A (A) | Beta-secretase 1 | polymer | 404 | 45156.7 | 1 | UniProt (P56817) Pfam (PF00026) | 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 |
2 | B (A) | 4-{[(5R,7S)-1-(3-fluorophenyl)-3,7-dimethyl-2,2-dioxido-2-thia-1,3,8-triazaspiro[4.5]dec-8-yl]methyl}-2-(propan-2-yloxy)phenol | non-polymer | 477.6 | 1 | Chemie (0UP) | |||
3 | C, D (A) | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
4 | E (A) | water | water | 18.0 | 461 | Chemie (HOH) |
Sequence modifications
A: -3 - 392 (UniProt: P56817)
PDB | External Database | Details |
---|---|---|
Arg 393 | - | expression tag |
Ser 394 | - | expression tag |
His 395 | - | expression tag |
His 396 | - | expression tag |
His 397 | - | expression tag |
His 398 | - | expression tag |
His 399 | - | expression tag |
His 400 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 45156.7 | |
Non-Polymers* | Number of molecules | 3 |
Total formula weight | 608.4 | |
All* | Total formula weight | 45765.1 |