Detail Information
P450 Protein:
| P450 Symbol | AurH |
| Protein Name | Putative cytochrome P450 |
| Uniprot ID | Q70KH6 |
| EC Number | 1.14.15.37 |
| Gene ID | 66737957 |
| Species | Streptomyces thioluteus |
| Txid | 66431 |
| 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 | C23H25NO3 → C23H23NO4 |
| Reaction Type | Oxidation |
| Chemical Bond | CH3 |
| Solvents | Dimethyl sulfoxide;Water |
| Conditions | 5 d, pH 7.4, 30°C |
AurH
Substrate Information:
| Substrate Name | 4-[(1E,3E)-6-(6-Methoxy-3,5-dimethyl-4-oxo-4H-pyran-2-yl)-2,4-dimethyl-1,3-hexadien-1-yl]benzonitrile (ACI) |
| Substrate Chemical Formula | C23H25NO3 |
| Substrate PubChem CID | 44251056 |
| Substrate Smiles | N#CC1=CC=C(C=C1)C=C(C=C(C)CCC=2OC(OC)=C(C(=O)C2C)C)C |
| Substrate Structure |
Product Information:
| Product Name | 4-[(1E)-3-[(3Z,5R)-Dihydro-5-(6-methoxy-3,5-dimethyl-4-oxo-4H-pyran-2-yl)-3(2H)-furanylidene]-2-methyl-1-propen-1-yl]benzonitrile (ACI) |
| Product Chemical Formula | C23H23NO4 |
| Product PubChem CID | 11494585 |
| Product CAS Number | 850894-85-8 |
| Product Smiles | N#CC1=CC=C(C=C1)C=C(C=C2COC(C=3OC(OC)=C(C(=O)C3C)C)C2)C |
| Product Structure |
References:
| Title: | Exploiting enzymatic promiscuity to engineer a focused library of highly selective antifungal and antiproliferative aureothin analogues. |
| PMID: | 20662518 |
| Journal: | Journal of the American Chemical Society |
| Year: | 2010/6/13 |