4R1L
Crystal structure of a Putative Acyl-CoA ligase (BT_0428) from Bacteroides thetaiotaomicron VPI-5482 at 2.42 A resolution
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) | Phenylacetate-coenzyme A ligase | polymer | 436 | 50204.0 | 4 | UniProt (Q8AAN6) Pfam (PF00501) Pfam (PF14535) | Bacteroides thetaiotaomicron | |
| 2 | E, JA, T, Z (A, D, B, C) | ZINC ION | non-polymer | 65.4 | 4 | Chemie (ZN) | |||
| 3 | F, KA, U (A, D, B) | ADENOSINE-5'-DIPHOSPHATE | non-polymer | 427.2 | 3 | Chemie (ADP) | |||
| 4 | AA, G (C, A) | ADENOSINE MONOPHOSPHATE | non-polymer | 347.2 | 2 | Chemie (AMP) | |||
| 5 | BA, H (C, A) | COENZYME A | non-polymer | 767.5 | 2 | Chemie (COA) | |||
| 6 | CA, DA, I, J, K... (C, A, D) | POTASSIUM ION | non-polymer | 39.1 | 6 | Chemie (K) | |||
| 7 | L (A) | TRIETHYLENE GLYCOL | non-polymer | 150.2 | 1 | Chemie (PGE) | |||
| 8 | EA, FA, M, N, NA... (C, A, D, B) | SULFATE ION | non-polymer | 96.1 | 7 | Chemie (SO4) | |||
| 9 | GA, HA, IA, OA, P... (C, D, A, B) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 12 | Chemie (EDO) | |||
| 10 | MA (D) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 1 | Chemie (PEG) | |||
| 11 | QA, RA, SA, TA (A, B, C, D) | water | water | 18.0 | 556 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 1 - 435 (UniProt: Q8AAN6)
| PDB | External Database | Details |
|---|---|---|
| Gly 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 200816.0 | |
| Non-Polymers* | Number of molecules | 38 |
| Total formula weight | 5680.9 | |
| All* | Total formula weight | 206496.9 |
