7CCF
Mechanism insights on steroselective oxidation of phosphorylated ethylphenols with cytochrome P450 CreJ
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Cytochrome P450 | polymer | 455 | 51214.5 | 1 | UniProt (Q8NSW2) Pfam (PF00067) | Corynebacterium glutamicum | |
| 2 | B (A) | PROTOPORPHYRIN IX CONTAINING FE | non-polymer | 616.5 | 1 | Chemie (HEM) | |||
| 3 | C, D (A) | (3-ethylphenyl) dihydrogen phosphate | non-polymer | 202.1 | 2 | Chemie (FW6) | |||
| 4 | E (A) | water | water | 18.0 | 56 | Chemie (HOH) |
Sequence modifications
A: 23 - 428 (UniProt: Q8NSW2)
| PDB | External Database | Details |
|---|---|---|
| Met -26 | - | expression tag |
| His -25 | - | expression tag |
| His -24 | - | expression tag |
| His -23 | - | expression tag |
| His -22 | - | expression tag |
| His -21 | - | expression tag |
| His -20 | - | expression tag |
| Ser -19 | - | expression tag |
| Ser -18 | - | expression tag |
| Gly -17 | - | expression tag |
| Leu -16 | - | expression tag |
| Val -15 | - | expression tag |
| Pro -14 | - | expression tag |
| Arg -13 | - | expression tag |
| Gly -12 | - | expression tag |
| Ser -11 | - | expression tag |
| Gly -10 | - | expression tag |
| Met -9 | - | expression tag |
| Lys -8 | - | expression tag |
| Glu -7 | - | expression tag |
| Thr -6 | - | expression tag |
| Ala -5 | - | expression tag |
| Ala -4 | - | expression tag |
| Ala -3 | - | expression tag |
| Lys -2 | - | expression tag |
| Phe -1 | - | expression tag |
| Glu 0 | - | expression tag |
| Arg 1 | - | expression tag |
| Gln 2 | - | expression tag |
| His 3 | - | expression tag |
| Met 4 | - | expression tag |
| Asp 5 | - | expression tag |
| Ser 6 | - | expression tag |
| Pro 7 | - | expression tag |
| Asp 8 | - | expression tag |
| Leu 9 | - | expression tag |
| Gly 10 | - | expression tag |
| Thr 11 | - | expression tag |
| Asp 12 | - | expression tag |
| Asp 13 | - | expression tag |
| Asp 14 | - | expression tag |
| Asp 15 | - | expression tag |
| Lys 16 | - | expression tag |
| Ala 17 | - | expression tag |
| Met 18 | - | expression tag |
| Ala 19 | - | expression tag |
| Asp 20 | - | expression tag |
| Ile 21 | - | expression tag |
| Gly 22 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 51214.5 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 1020.8 | |
| All* | Total formula weight | 52235.2 |
