About: RMSD plots for the complex established with isoeleutherin (Pink)

709E

Evaluation of the genotoxicity and mutagenicity of isoeleutherin and eleutherin isolated from Eleutherine plicata herb. using bioassays and in silico approaches

Download

Information

Details.

Scientist
Jorddy Neves
Protein
TOPO II
Ligand
isoeleutherin
Simulation Duration
100ns
InChIKey
IAJIIJBMBCZPSW-RKDXNWHRSA-N  
SMILES
C[C@@H]1CC2=C([C@H](O1)C)C(=O)C3=C(C2=O)C=CC=C3OC 
Molecular Formula
C16H16O4 
Protein Details
Isoeleutherin plays an important role in selective modulation of T helper cell-mediated immune responses.
Ligand Details
Catalyzes the reversible transfer of the terminal phosphate group between ATP and AMP. Plays an important role in cellular energy homeostasis and in adenine nucleotide metabolism.
Attachments