1TA2
Crystal structure of thrombin in complex with compound 1
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | thrombin | polymer | 287 | 33080.0 | 1 | UniProt (P00734) Pfam (PF09396) Pfam (PF00089) | Homo sapiens (human) | Coagulation factor II |
| 2 | B (B) | Hirudin | polymer | 11 | 1376.4 | 1 | UniProt (P28504) | Hirudo medicinalis | |
| 3 | C (A) | 1-(2-AMINO-3,3-DIPHENYL-PROPIONYL)-PYRROLIDINE-3-CARBOXYLIC ACID 2,5-DICHLORO-BENZYLAMIDE | non-polymer | 496.4 | 1 | Chemie (176) | |||
| 4 | D, E (A, B) | water | water | 18.0 | 152 | Chemie (HOH) |
Sequence modifications
B: 355 - 365 (UniProt: P28504)
| PDB | External Database | Details |
|---|---|---|
| Ala 362 | Glu 62 | conflict |
| Ala 365 | Gln 65 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 34456.4 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 496.4 | |
| All* | Total formula weight | 34952.8 |
