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Ligand · A8W

A8W · Pregnenolone sulfate

A8W, Pregnenolone sulfate (C21 H32 O5 S, 396.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
A8W
Formula
C21 H32 O5 S
Class
ligand
Structures
2
PDB entries
2

Binding sites

A8W in 2 structures; the first of them:

  • 8RH9 · CryoEM structure of human rho1 GABAA receptor in complex with pregnenolone sulfate · A8W B509 · binds PRO311, PRO315, THR319, LEU322, PRO311, PRO315, THR319, LEU322 and 12 more
  • 5OSC · Glic-gabaar ALPHA1 chimera crystallized in complex with pregnenolone sulfate at pH 4.5 · A8W A503 · binds ARG316, LEU394, ALA398, PHE399

Residues it binds most

PRO 1, LEU 5, PHE 5, ALA 5, THR 1, ARG 4, ILE 1, SER 1 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • D10 · Decane
  • D12 · Dodecane
  • Y01 · Cholesterol hemisuccinate
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • ACT · Acetate ion
  • HEX · Hexane
  • OCT · N-octane

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