Ligand name: 16-epi-Vellosimine
PDB ligand accession: EVS
DrugBank: n/a
PubChem: 11335328
ChEMBL: n/a
InChI Key: MHASSCPGKAMILD-MIOJWWSHSA-N
SMILES: CC=C1CN2C3Cc4c5ccccc5[nH]c4C2CC1C3C=O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Alkaloids and derivatives
    • Class: Macroline alkaloids
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q9SE93

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3GZJ	Download	Experimental	e3gzjA1 e3gzjB1 e3gzjC1 e3gzjD1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot