Ligand name: allopregnanolone
PDB ligand accession: Y4B
DrugBank: DB11859
PubChem: 92786
ChEMBL: CHEMBL207538
InChI Key: AURFZBICLPNKBZ-SYBPFIFISA-N
SMILES: CC(=O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Steroids and steroid derivatives
      • Subclass: Pregnane steroids

List of PDB structures and/or AlphaFold models with target protein P63137

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8G4N	Download	Experimental	e8g4nA1 e8g4nE2 e8g4nC2 e8g4nB2	Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore	LigPlot
8G5H	Download	Experimental	e8g5hE1 e8g5hA1	Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore	LigPlot
8FOI	Download	Experimental	e8foiB2 e8foiC2 e8foiA2 e8foiE2	Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore	LigPlot
8G5F	Download	Experimental	e8g5fA1 e8g5fE2 e8g5fB1 e8g5fC1	Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore	LigPlot
8G4X	Download	Experimental	e8g4xA1 e8g4xE1 e8g4xC2 e8g4xB1	Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore	LigPlot
8G5G	Download	Experimental	e8g5gA2 e8g5gE2	Neurotransmitter-gated ion-channel transmembrane pore Neurotransmitter-gated ion-channel transmembrane pore	LigPlot