12CW
D189K thrombin inhibited with D-Phe-Pro-Arg-Chloromethylketone
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 light chain | polymer | 49 | 5641.2 | 1 | UniProt (P00734) | Homo sapiens (human) | |
| 2 | B (B) | Thrombin heavy chain | polymer | 273 | 31439.1 | 1 | UniProt (P00734) | Homo sapiens (human) | |
| 3 | C (B) | D-phenylalanyl-N-[(2S,3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-hydroxyhexan-3-yl]-L-prolinamide | non-polymer | 454.0 | 1 | Chemie (0G6) | |||
| 4 | D, E (A, B) | water | water | 18.0 | 157 | Chemie (HOH) |
Sequence modifications
B: 321 - 579 (UniProt: P00734)
| PDB | External Database | Details |
|---|---|---|
| Lys 519 | Asp 562 | engineered mutation |
| Tyr 580 | - | expression tag |
| Leu 581 | - | expression tag |
| Glu 582 | - | expression tag |
| Asp 583 | - | expression tag |
| Gln 584 | - | expression tag |
| Val 585 | - | expression tag |
| Asp 586 | - | expression tag |
| Pro 587 | - | expression tag |
| Arg 588 | - | expression tag |
| Leu 589 | - | expression tag |
| Ile 590 | - | expression tag |
| Asp 591 | - | expression tag |
| Gly 592 | - | expression tag |
| Lys 593 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 37080.3 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 454.0 | |
| All* | Total formula weight | 37534.3 |
