Detail Information

P450 Protein:

P450 SymbolRebP
Protein NameRebP-like cytochrome P450
Uniprot IDA0A8F5FCX1
SpeciesStreptomyces sp.
Txid 1931
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 C11H11FN2O2 → C20H11F2N3O
Reaction Typecyclization reaction
Chemical Bond
SolventsWater
Conditions20 h, pH 7.0, 25°C; 15 min, 85°C
Transformations1.Transamination 2.Decarboxylation of Aliphatic Acids 3.Reduction of the C-N Bond/ Deamination

(2S)-2-amino-3-(4-fluoro-1H-indol-3-yl)propanoic acid

RebP

8,18-difluoro-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4(9),5,7,10,15,17(22),18,20-nonaen-12-one

Substrate Information:

Substrate Name (2S)-2-amino-3-(4-fluoro-1H-indol-3-yl)propanoic acid
Substrate Chemical FormulaC11H11FN2O2
Substrate PubChem CID688475
Substrate SmilesC1=CC2=C(C(=C1)F)C(=CN2)C[C@@H](C(=O)O)N
Substrate Structure

Product Information:

Product Name 8,18-difluoro-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4(9),5,7,10,15,17(22),18,20-nonaen-12-one
Product Chemical FormulaC20H11F2N3O
Product PubChem CID148641925
Product CAS Number2305201-23-2
Product SmilesC1C2=C3C4=C(C=CC=C4F)NC3=C5C(=C2C(=O)N1)C6=C(N5)C=CC=C6F
Product Structure

References:

Title: 一种星孢菌素中间体K252c及其衍生物的催化合成体系及催化合成方法
Patent ID: CN112852899
Journal:
Year: 2021/5/28

Contact zhy1001@alu.uestc.edu.cn or yangzhang@cdutcm.edu.cn
© Department of Bioinformatics