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Ligand · OTK

OTK · (3S,3aR,4S,6S,6aS,8R,9R,9aR,9bS)-6-(acetyloxy)-4-(butanoyloxy)-3,3a-dihydroxy-3,6,9-trimethyl-2-oxododecahydroazuleno[4,5-b]furan-8-yl (2Z)-2-methylbut-2-enoate

OTK, (3S,3aR,4S,6S,6aS,8R,9R,9aR,9bS)-6-(acetyloxy)-4-(butanoyloxy)-3,3a-dihydroxy-3,6,9-trimethyl-2-oxododecahydroazuleno[4,5-b]furan-8-yl (2Z)-2-methylbut-2-enoate (C26 H38 O10, 510.6 g/mol), in the MolNFT structures on GenesisL1: bound…

Component
OTK
Formula
C26 H38 O10
Class
ligand
Structures
2
PDB entries
1

Binding sites

OTK in 2 structures; the first of them:

  • 3NAM · SR Ca(2+)-ATPase in the HnE2 state complexed with the Thapsigargin derivative dOTg · OTK A997 · binds GLU255, PHE256, GLN259, LEU260, VAL263, ALA306, ILE761, ILE765 and 8 more
  • 3NAM · Sr CA(2+)-ATPase in the HNE2 state complexed with the thapsigargin derivative dotg · OTK A997 · binds GLU255, PHE256, GLN259, LEU260, VAL263, ALA306, ILE761, ILE765 and 8 more

Residues it binds most

ILE 2, VAL 2, LEU 2, PHE 2, ALA 2, ASN 2, GLN 2, GLU 2, MET 2, TYR 2 (residue and the binding sites it lines).

Found with

  • PTY · Phosphatidylethanolamine
  • MG · Magnesium ion
  • NA · Sodium ion

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