5T9W
Discovery of a Potent Cyclophilin Inhibitor (Compound 5) based on Structural Simplification of Sanglifehrin A
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Peptidyl-prolyl cis-trans isomerase A | polymer | 164 | 17905.3 | 1 | UniProt (P62937) Pfam (PF00160) | Homo sapiens (Human) | PPIase A,Cyclophilin A,Cyclosporin A-binding protein,Rotamase A |
| 2 | B (A) | 3-[(3-hydroxyphenyl)methyl]-6-(propan-2-yl)-19-oxa-1,4,7,25-tetraazabicyclo[19.3.1]pentacosa-13,15-diene-2,5,8,20-tetrone | non-polymer | 554.7 | 1 | BIRD (PRD_002241) Chemie (78E) | |||
| 3 | C (A) | water | water | 18.0 | 211 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 17905.3 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 554.7 | |
| All* | Total formula weight | 18460.0 |
