Detail Information
P450 Protein:
| P450 Symbol | CYP102A1 |
| Protein Name | Bifunctional cytochrome P450/NADPH--P450 reductase |
| Uniprot ID | P14779 |
| EC Number | 1.14.14.1 |
| Gene ID | 93643681 |
| Species | Bacillus megaterium (strain ATCC 14581 / DSM 32 / JCM 2506 / NBRC 15308 / NCIMB 9376 / NCTC 10342 / NRRL B-14308 / VKM B-512) |
| Txid | 1348623 |
| P450 Protein Structure |
Model Confidence (pLDDT)
Very high (>90)
High (90 > 70)
Low (70 > 50)
Very low (<50)
|
| Subcellular Location | |
| Protein Sequence | GO |
Reaction Scheme:
| Chemical Conversion | C13H16O3 → C13H16O4 |
| Reaction Type | Oxidation |
| Chemical Bond | C=C |
| Solvents | Dichloromethane;2,2,4-Trimethylpentane;Water |
| Conditions | 12 h, pH 7.4, rt |
CYP102A1
Substrate Information:
| Substrate Name | (E)-4-(Hex-3-en-1-yloxy)benzoic acid |
| Substrate Chemical Formula | C13H16O3 |
| Substrate Smiles | O=C(O)c1ccc(OCC/C=C/CC)cc1 |
| Substrate Structure |
Product Information:
| Product Name | 4-[2-(3-ethyloxiran-2-yl)ethoxy]benzoic acid |
| Product Chemical Formula | C13H16O4 |
| Product Smiles | O=C(O)c1ccc(OCCC2OC2CC)cc1 |
| Product Structure |
References:
| Title: | Cooperative tandem catalysis by an organometallic complex and a metalloenzyme. |
| PMID: | 24536102 |
| Journal: | Angewandte Chemie, International Edition |
| Year: | 2013/11/25 |