9RG5
Unspecific peroxygenase from Psathyrella aberdarensis, Grogu variant, in complex with veratryl alcohol
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) | Heme-thiolate peroxidase | polymer | 334 | 36575.5 | 2 | UniProt (A0A4Q2DF39) | Candolleomyces aberdarensis | |
| 2 | C, D, E (J, K, T) | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 424.4 | 3 | In PDB GlyTouCan (G42666HT) | |||
| 3 | F (U) | beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 586.5 | 1 | In PDB GlyTouCan (G15407YE) | |||
| 4 | AA, BA, G, H (B, A) | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 4 | Chemie (NAG) | |||
| 5 | DA, I (B, A) | PROTOPORPHYRIN IX CONTAINING FE | non-polymer | 616.5 | 2 | Chemie (HEM) | |||
| 6 | J (A) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 1 | Chemie (PEG) PubChem (8117) | |||
| 7 | CA, K, L (B, A) | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID | non-polymer | 195.2 | 3 | Chemie (MES) PubChem (4478249) | |||
| 8 | M, N (A) | ETHANOL | non-polymer | 46.1 | 2 | Chemie (EOH) | |||
| 9 | GA, HA, IA, JA, KA... (B, A) | ZINC ION | non-polymer | 65.4 | 15 | Chemie (ZN) | |||
| 10 | MA, X (B, A) | MAGNESIUM ION | non-polymer | 24.3 | 2 | Chemie (MG) PubChem (888) | |||
| 11 | NA, Y (B, A) | PHOSPHATE ION | non-polymer | 95.0 | 2 | Chemie (PO4) PubChem (1061) | |||
| 12 | EA, OA, PA, QA, Z (B, A) | GLYCEROL | non-polymer | 92.1 | 5 | Chemie (GOL) PubChem (753) | |||
| 13 | FA (B) | Veratryl alcohol | non-polymer | 168.2 | 1 | Chemie (VOH) PubChem (7118) | |||
| 14 | RA, SA (A, B) | water | water | 18.0 | 758 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 334 (UniProt: A0A4Q2DF39)
| PDB | External Database | Details |
|---|---|---|
| Ala 61 | Ser 106 | engineered mutation |
| Ile 79 | Leu 124 | engineered mutation |
| Leu 252 | Ala 297 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 73151.0 | |
| Branched | Number of molecules | 4 |
| Total formula weight | 1859.7 | |
| Non-Polymers* | Number of molecules | 37 |
| Total formula weight | 4750.1 | |
| All* | Total formula weight | 79760.9 |
