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STRUCTURAL ANALYSIS OF THE ACTIVE SITE OF PORCINE PANCREATIC ELASTASE BASED ON THE X-RAY CRYSTAL STRUCTURES OF COMPLEXES WITH TRIFLUOROACETYL-DIPEPTIDE-ANILIDE INHIBITORS
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A (E) | ELASTASE | polymer | 240 | 25928.0 | 1 | UniProt (P00772) Pfam (PF00089) | Sus scrofa (pig) | |
2 | B (E) | N-(trifluoroacetyl)-L-valyl-N-[4-(trifluoromethyl)phenyl]-L-alaninamide | non-polymer | 427.3 | 1 | BIRD (PRD_000360) Chemie (0QN) | |||
3 | C (E) | CALCIUM ION | non-polymer | 40.1 | 1 | Chemie (CA) | |||
4 | D (E) | SULFATE ION | non-polymer | 96.1 | 1 | Chemie (SO4) | |||
5 | E (E) | water | water | 18.0 | 137 | Chemie (HOH) |
Sequence modifications
E: 16 - 255 (UniProt: P00772)
PDB | External Database | Details |
---|---|---|
Asn 81 | Asp 92 | conflict |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 25928.0 | |
Non-Polymers* | Number of molecules | 3 |
Total formula weight | 563.5 | |
All* | Total formula weight | 26491.5 |