7THC
Structure of Cyclophilin D Peptidyl-Prolyl Isomerase Domain bound to Macrocyclic Inhibitor B25
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 F, mitochondrial | polymer | 163 | 17595.1 | 1 | UniProt (P30405) Pfam (PF00160) | Homo sapiens (human) | PPIase F,Cyclophilin D,CyP-D,CypD,Cyclophilin F,Mitochondrial cyclophilin,CyP-M,Rotamase F |
| 2 | B (A) | 3-(4'-{[(4S,7S,11R,13E,19S)-19-{[2-(2-aminoethoxy)ethyl]carbamoyl}-7-benzyl-3,6,12,15,21-pentaoxo-1,3,4,5,6,7,8,9,10,12,15,16,17,18,19,20,21,22-octadecahydro-2H-7,11-methano-2,5,11,16,20-benzopentaazacyclotetracosin-4-yl]methyl}[1,1'-biphenyl]-4-yl)prop-2-ynoic acid | non-polymer | 924.0 | 1 | Chemie (I4Z) | |||
| 3 | C (A) | water | water | 18.0 | 243 | Chemie (HOH) |
Sequence modifications
A: 45 - 207 (UniProt: P30405)
| PDB | External Database | Details |
|---|---|---|
| Ile 175 | Lys 175 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 17595.1 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 924.0 | |
| All* | Total formula weight | 18519.1 |
