Detail Information
P450 Protein:
| P450 Symbol | CYP101B1 |
| Protein Name | cytochrome P450 monooxygenase enzyme CYP101B1 |
| Uniprot ID | |
| Species | Novosphingobium aromaticivorans DSM12444 |
| Txid | 279238 |
| 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 | C12H12 → C12H12O + C12H12O |
| Reaction Type | Oxidation |
| Chemical Bond | CH |
| Solvents | Water |
| Conditions | pH 7.4 |
| Transformations | Hydroxylation at an Aliphatic Carbon |
CYP101B1
+
Substrate Information:
| Substrate Name | Naphthalene, 2-ethyl- (6CI, 8CI, 9CI, ACI) |
| Substrate Chemical Formula | C12H12 |
| Substrate PubChem CID | 13652 |
| Substrate Smiles | C=1C=CC=2C=C(C=CC2C1)CC |
| Substrate Structure |
Product Information:
| Product Name | 2-Naphthalenemethanol,alpha-methyl-,(alphaR)-(9CI, ACI) |
| Product Chemical Formula | C12H12O |
| Product PubChem CID | 98243 |
| Product CAS Number | 52193-85-8 |
| Product Smiles | OC(C=1C=CC=2C=CC=CC2C1)C |
| Product Structure |
| Product Name | 2-Naphthalenemethanol, alpha-methyl-, (alphaS)- (9CI, ACI) |
| Product Chemical Formula | C12H12O |
| Product PubChem CID | 98243 |
| Product CAS Number | 27544-18-9 |
| Product Smiles | OC(C=1C=CC=2C=CC=CC2C1)C |
| Product Structure |
References:
| Title: | The selective oxidation of substituted aromatic hydrocarbons and the observation of uncoupling via redox cycling during naphthalene oxidation by the CYP101B1 system |
| DOI: | https://doi.org/10.1039/C7CY00088J |
| Journal: | Catalysis Science & Technology |
| Year: | 2017/3/10 |