5T4S
Novel Approach of Fragment-Based Lead Discovery applied to Renin Inhibitors
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | Renin | polymer | 339 | 37153.9 | 2 | UniProt (P00797) Pfam (PF00026) | Homo sapiens (Human) | Angiotensinogenase |
| 2 | C, G (A, B) | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 2 | Chemie (NAG) | |||
| 3 | D (A) | 1-(2-METHOXY-ETHOXY)-2-{2-[2-(2-METHOXY-ETHOXY]-ETHOXY}-ETHANE | non-polymer | 266.3 | 1 | Chemie (PG6) | |||
| 4 | E, F (A) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 2 | Chemie (DMS) | |||
| 5 | H (B) | 6-chloro-N-[(furan-2-yl)methyl]pyrazin-2-amine | non-polymer | 209.6 | 1 | Chemie (77O) | |||
| 6 | I (B) | TRIETHYLENE GLYCOL | non-polymer | 150.2 | 1 | Chemie (PGE) | |||
| 7 | J, K (A, B) | water | water | 18.0 | 141 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 74307.7 | |
| Non-Polymers* | Number of molecules | 7 |
| Total formula weight | 1224.8 | |
| All* | Total formula weight | 75532.5 |
