Detail Information

P450 Protein:

P450 SymbolCYP1251 C3
Protein NameCytochrome P450Blt
Uniprot IDA0ACD6BAH8
EC Number1.14.-.-
SpeciesMicromonospora sp. MW-13
Txid 2094022
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 C29H44N10O7S2 → C29H42N10O7S2
Reaction TypeCyclization
Chemical Bond
SolventsWater
Conditionsovernight, 30°C

N-[(5S,8S,11S,14R)-5-amino-8-(3-{[amino(azanylidene)methyl]amino}propyl)-11-[(4-hydroxyphenyl)methyl]-6,9,12,15-tetraoxo-14-(sulfanylmethyl)-2-thia-7,10,13-triazapentadec-15-yl]-L-histidine

CYP1251 C3

(7S,10R,13S)-13-{[(5S,8S)-5-amino-8-(3-{[amino(azanylidene)methyl]amino}propyl)-6,9-dioxo-7-aza-2-thianon-9-yl]amino}-18-hydroxy-9,12-dioxo-10-(sulfanylmethyl)-2,4,8,11-tetrazatricyclo[13.3.1.12,5]icosa-1(19),3,5(20),15(16),17-pentaene-7-carboxylic acid

Substrate Information:

Substrate Name N-[(5S,8S,11S,14R)-5-amino-8-(3-{[amino(azanylidene)methyl]amino}propyl)-11-[(4-hydroxyphenyl)methyl]-6,9,12,15-tetraoxo-14-(sulfanylmethyl)-2-thia-7,10,13-triazapentadec-15-yl]-L-histidine
Substrate Chemical FormulaC29H44N10O7S2
Substrate Smiles[C@@H](CC1=CC=C(O)C=C1)(NC([C@@H](NC([C@H](CCSC)N)=O)CCCNC(=N)N)=O)C(N[C@H](C(N[C@@H](CC2=CN=CN2)C(O)=O)=O)CS)=O
Substrate Structure

Product Information:

Product Name (7S,10R,13S)-13-{[(5S,8S)-5-amino-8-(3-{[amino(azanylidene)methyl]amino}propyl)-6,9-dioxo-7-aza-2-thianon-9-yl]amino}-18-hydroxy-9,12-dioxo-10-(sulfanylmethyl)-2,4,8,11-tetrazatricyclo[13.3.1.12,5]icosa-1(19),3,5(20),15(16),17-pentaene-7-carboxylic acid
Product Chemical FormulaC29H42N10O7S2
Product CAS Number2951913-38-3
Product SmilesOC1=C2N3C=C(N=C3)C[C@@H](C(O)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](NC([C@@H](NC([C@H](CCSC)N)=O)CCCNC(=N)N)=O)CC(=C2)C=C1
Product Structure

References:

Title: Cytochrome P450(Blt) Enables Versatile Peptide Cyclisation to Generate Histidine- and Tyrosine-Containing Crosslinked Tripeptide Building Blocks.
PMID: 35851739
Journal: Angewandte Chemie, International Edition
Year: 2022/7/18

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