5C37
Structure of the beta-ketoacyl reductase domain of human fatty acid synthase bound to a spiro-imidazolone inhibitor
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, C) | Fatty acid synthase | polymer | 664 | 72049.2 | 2 | UniProt (P49327) Pfam (PF08242) Pfam (PF21149) Pfam (PF08659) | Homo sapiens (Human) | |
| 2 | C, F (A, C) | NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE | non-polymer | 745.4 | 2 | Chemie (NDP) | |||
| 3 | D, H (A, C) | 6-{[(3R)-1-(cyclopropylcarbonyl)pyrrolidin-3-yl]methyl}-5-[4-(1-methyl-1H-indazol-5-yl)phenyl]-4,6-diazaspiro[2.4]hept-4-en-7-one | non-polymer | 467.6 | 2 | Chemie (4XN) | |||
| 4 | E, I, J (A, C) | CHLORIDE ION | non-polymer | 35.5 | 3 | Chemie (CL) | |||
| 5 | G (C) | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
| 6 | K, L (A, C) | water | water | 18.0 | 235 | Chemie (HOH) |
Sequence modifications
A, C: 1108 - 1874 (UniProt: P49327)
A, C: 1877 - 2122 (UniProt: P49327)
A, C: 1877 - 2122 (UniProt: P49327)
| PDB | External Database | Details |
|---|---|---|
| Gly 1875 | - | linker |
| Gly 1876 | - | linker |
| Gly 1880 | Phe 1880 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 144098.5 | |
| Non-Polymers* | Number of molecules | 8 |
| Total formula weight | 2624.4 | |
| All* | Total formula weight | 146722.9 |
