7L00
Crystal Structure of C. difficile Enoyl-Acyl Carrier Protein Reductase (FabK) in Complex with an 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, C, D (A, B, C, D) | Enoyl-Acyl Carrier Protein Reductase FabK | polymer | 315 | 33200.7 | 4 | UniProt (A0A031WIF2) | Clostridioides difficile | 2-nitropropane dioxygenase,Enoyl-(Acyl-carrier-protein) reductase II,Enoyl-[acyl-carrier-protein] reductase FabK,Nitronate monooxygenase,Trans-2-enoyl-ACP reductase |
| 2 | E, J, N, S (A, B, C, D) | FLAVIN MONONUCLEOTIDE | non-polymer | 456.3 | 4 | Chemie (FMN) | |||
| 3 | F, K, O, T (A, B, C, D) | N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-2-[2-(1H-pyrrol-1-yl)-1,3-thiazol-4-yl]acetamide | non-polymer | 418.5 | 4 | Chemie (XCJ) | |||
| 4 | G, H, L, M, P... (A, B, C, D) | SODIUM ION | non-polymer | 23.0 | 8 | Chemie (NA) | |||
| 5 | I, R (A, C) | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) | |||
| 6 | W, X, Y, Z (A, B, C, D) | water | water | 18.0 | 711 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 1 - 309 (UniProt: A0A031WIF2)
| PDB | External Database | Details |
|---|---|---|
| Val -5 | - | expression tag |
| Pro -4 | - | expression tag |
| Arg -3 | - | expression tag |
| Gly -2 | - | expression tag |
| Ser -1 | - | expression tag |
| His 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 132802.9 | |
| Non-Polymers* | Number of molecules | 18 |
| Total formula weight | 3867.5 | |
| All* | Total formula weight | 136670.4 |
