6APW
Crystal structure of Staphylococcus aureus biotin protein ligase in complex with inhibitor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Bifunctional ligase/repressor BirA | polymer | 329 | 38015.8 | 1 | UniProt (A0A181HT70) | Staphylococcus aureus | Biotin--[acetyl-CoA-carboxylase] ligase,Biotin--protein ligase,Biotin-[acetyl-CoA carboxylase] synthetase |
| 2 | B (A) | 4-[(4-{5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentyl}-1H-1,2,3-triazol-1-yl)methyl]benzoic acid | non-polymer | 415.5 | 1 | Chemie (BTV) | |||
| 3 | C (A) | water | water | 18.0 | 7 | Chemie (HOH) |
Sequence modifications
A: 1 - 323 (UniProt: A0A181HT70)
| PDB | External Database | Details |
|---|---|---|
| Asn 272 | Ile 272 | conflict |
| His 324 | - | expression tag |
| His 325 | - | expression tag |
| His 326 | - | expression tag |
| His 327 | - | expression tag |
| His 328 | - | expression tag |
| His 329 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 38015.8 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 415.5 | |
| All* | Total formula weight | 38431.3 |
