Detail Information
P450 Protein:
| P450 Symbol | CYP71BE50 |
| Protein Name | |
| Uniprot ID | |
| Species | Andrographis Paniculata |
| Txid | 175694 |
| P450 Protein Structure |
Model Confidence (pLDDT)
Very high (>90)
High (90 > 70)
Low (70 > 50)
Very low (<50)
|
| Subcellular Location | |
| Protein Sequence | GO |
| Remarks | GenBase: C_AA104980.1 |
Reaction Scheme:
| Chemical Conversion | C20H32O3 → C20H30O3 |
| Reaction Type | Cyclization |
| Chemical Bond |
CYP71BE50
Substrate Information:
| Substrate Name | ent-labda-8(17),13-dien-15,19-diol-16-enal |
| Substrate Chemical Formula | C20H32O3 |
| Substrate Smiles | [H][C@@]1([C@](C)2[C@]([H])(CCC1=C)[C@](CO)(CCC2)C)CC/C(/C=O)=C/CO |
| Substrate Structure |
Product Information:
| Product Name | andrograpanin |
| Product Chemical Formula | C20H30O3 |
| Product PubChem CID | 11666871 |
| Product Smiles | C[C@]1(CCC[C@@]2([C@@H]1CCC(=C)[C@H]2CCC3=CCOC3=O)C)CO |
| Product Structure |
References:
| Title: | Completing the Biosynthesis of the Clinically Important Diterpenoid Andrographolide in Andrographis Paniculata. |
| PMID: | 40364767 |
| Journal: | Angew Chem Int Ed Engl |
| Year: | 2025/5/14 |