8WKF
Rational Design of Highly Selective PDE5 inhibitors for the Treatment of Idiopathic Pulmonary Fibrosis
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | cGMP-specific 3',5'-cyclic phosphodiesterase | polymer | 333 | 38478.2 | 1 | UniProt (O76074) Pfam (PF00233) | Homo sapiens (human) | cGMP-binding cGMP-specific phosphodiesterase,CGB-PDE |
| 2 | B (A) | 3-[2-[[5-chloranyl-2-[(3-fluorophenyl)methylamino]phenyl]methyl]-4-oxidanylidene-3~{H}-quinazolin-7-yl]prop-2-enoic acid | non-polymer | 463.9 | 1 | Chemie (WD3) | |||
| 3 | C (A) | ZINC ION | non-polymer | 65.4 | 1 | Chemie (ZN) | |||
| 4 | D (A) | MAGNESIUM ION | non-polymer | 24.3 | 1 | Chemie (MG) | |||
| 5 | E (A) | water | water | 18.0 | 100 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 38478.2 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 553.6 | |
| All* | Total formula weight | 39031.8 |
