3V1U
Crystal structure of a beta-ketoacyl reductase FabG4 from Mycobacterium tuberculosis H37Rv complexed with NAD+ and Hexanoyl-CoA at 2.5 Angstrom resolution
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | 3-oxoacyl-(Acyl-carrier-protein) reductase | polymer | 462 | 47851.0 | 1 | UniProt (O53665) Pfam (PF13561) | Mycobacterium tuberculosis | PROBABLE 3-OXOACYL-[ACYL-CARRIER PROTEIN] REDUCTASE FABG4 (3-KETOACYL-ACYL CARRIER PROTEIN REDUCTASE) |
| 2 | B (A) | NICOTINAMIDE-ADENINE-DINUCLEOTIDE | non-polymer | 663.4 | 1 | Chemie (NAD) | |||
| 3 | C (A) | HEXANOYL-COENZYME A | non-polymer | 865.7 | 1 | Chemie (HXC) | |||
| 4 | D (A) | (2S,5R,8R,11S,14S,17S,21R)-5,8,11,14,17-PENTAMETHYL-4,7,10,13,16,19-HEXAOXADOCOSANE-2,21-DIOL | non-polymer | 424.6 | 1 | Chemie (ZPG) | |||
| 5 | E (A) | water | water | 18.0 | 122 | Chemie (HOH) |
Sequence modifications
A: 1 - 454 (UniProt: O53665)
| PDB | External Database | Details |
|---|---|---|
| His -7 | - | expression tag |
| His -6 | - | expression tag |
| His -5 | - | expression tag |
| His -4 | - | expression tag |
| His -3 | - | expression tag |
| His -2 | - | expression tag |
| Gly -1 | - | expression tag |
| Ser 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 47851.0 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 1953.7 | |
| All* | Total formula weight | 49804.7 |
