Detail Information
P450 Protein:
| P450 Symbol | penM |
| Protein Name | Pentalenolactone synthase |
| Uniprot ID | E3VWJ9 |
| EC Number | 1.14.19.8 |
| Species | Streptomyces exfoliatus (Streptomyces hydrogenans) |
| Txid | 1905 |
| P450 Protein Structure |
Model Confidence (pLDDT)
Very high (>90)
High (90 > 70)
Low (70 > 50)
Very low (<50)
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| Subcellular Location | / |
| Protein Sequence | GO |
Reaction Scheme:
| Chemical Conversion | C15H18O5 + Fe2S2 + O2 + H+ → C15H16O5 + Fe2S2 + H2O |
| Reaction Type | Oxidation |
| Chemical Bond | C-CH2 |
| RheaID | 34575 |
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penM
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Substrate Information:
| Substrate Name | Pentalenolactone F |
| Substrate Chemical Formula | C15H18O5 |
| Substrate PubChem CID | 11065764 |
| Substrate Smiles | CC1(C[C@H]2C=C([C@H]3[C@]2(C1)[C@@]4(CO4)C(=O)OC3)C(=O)O)C |
| Substrate Structure |
| Substrate Name | [2Fe-2S]1+ |
| Substrate Chemical Formula | Fe2S2 |
| Substrate Smiles | S1[Fe]S[Fe+]1 |
| Substrate Structure |
| Substrate Name | O2 |
| Substrate Chemical Formula | O2 |
| Substrate PubChem CID | 977 |
| Substrate CAS Number | 7782-44-7 |
| Substrate Smiles | O=O |
| Substrate Structure |
| Substrate Name | H+ |
| Substrate Chemical Formula | H+ |
| Substrate PubChem CID | 1038 |
| Substrate CAS Number | 12408-02-5 |
| Substrate Smiles | [H+] |
| Substrate Structure |
Product Information:
| Product Name | Pentalenolactone |
| Product Chemical Formula | C15H16O5 |
| Product PubChem CID | 24199350 |
| Product Smiles | C[C@H]1[C@H]2C=C([C@H]3[C@]2(C=C1C)[C@@]4(CO4)C(=O)OC3)C(=O)O |
| Product Structure |
| Product Name | [2Fe-2S]2+ |
| Product Chemical Formula | Fe2S2 |
| Product Smiles | S1[Fe+]S[Fe+]1 |
| Product Structure |
| Product Name | H2O |
| Product Chemical Formula | H2O |
| Product PubChem CID | 962 |
| Product CAS Number | 7732-18-5 |
| Product Smiles | O |
| Product Structure |
References:
| Title: | Genome mining in streptomyces. Discovery of an unprecedented P450-catalyzed oxidative rearrangement that is the final step in the biosynthesis of pentalenolactone. |
| PMID: | 21284395 |
| Journal: | Journal of the American Chemical Society |
| Year: | 2011/2/23 |