2Y27
crystal structure of PaaK1 in complex with ATP from Burkholderia cenocepacia
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, B) | PHENYLACETATE-COENZYME A LIGASE | polymer | 437 | 48709.6 | 2 | UniProt (B4E7B5) Pfam (PF00501) Pfam (PF14535) | BURKHOLDERIA CENOCEPACIA | PHENYLACETATE COA LIGASE |
| 2 | C, D, E, F, N... (A, B) | THIOCYANATE ION | non-polymer | 58.1 | 9 | Chemie (SCN) | |||
| 3 | G, S, T, U, V (A, B) | GLYCEROL | non-polymer | 92.1 | 5 | Chemie (GOL) | |||
| 4 | H, W, X, Y, Z (A, B) | BETA-MERCAPTOETHANOL | non-polymer | 78.1 | 5 | Chemie (BME) | |||
| 5 | I (A) | TETRAETHYLENE GLYCOL | non-polymer | 194.2 | 1 | Chemie (PG4) | |||
| 6 | AA, J (B, A) | ADENOSINE-5'-TRIPHOSPHATE | non-polymer | 507.2 | 2 | Chemie (ATP) | |||
| 7 | BA, CA, DA, K, L... (B, A) | MAGNESIUM ION | non-polymer | 24.3 | 6 | Chemie (MG) | |||
| 8 | EA, FA (A, B) | water | water | 18.0 | 948 | Chemie (HOH) |
Sequence modifications
A, B: 2 - 432 (UniProt: B4E7B5)
| PDB | External Database | Details |
|---|---|---|
| Gly -4 | - | expression tag |
| Ser -3 | - | expression tag |
| His -2 | - | expression tag |
| Mse -1 | - | expression tag |
| Ala 0 | - | expression tag |
| Ser 1 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 97419.3 | |
| Non-Polymers* | Number of molecules | 28 |
| Total formula weight | 2728.3 | |
| All* | Total formula weight | 100147.6 |
