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Ligand · 1HT

1HT · (3S,3aR,4S,6S,6aR,7S,8S,9bS)-6-(acetyloxy)-3a,4-bis(butanoyloxy)-3-hydroxy-3,6,9-trimethyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-2,3,3a,4,5,6,6a,7,8,9b-decahydroazuleno[4,5-b]furan-7-yl octanoate

1HT, (3S,3aR,4S,6S,6aR,7S,8S,9bS)-6-(acetyloxy)-3a,4-bis(butanoyloxy)-3-hydroxy-3,6,9-trimethyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-2,3,3a,4,5,6,6a,7,8,9b-decahydroazuleno[4,5-b]furan-7-yl octanoate (C38 H56 O13, 720.8 g/mol), in the…

Component
1HT
Formula
C38 H56 O13
Class
ligand
Structures
2
PDB entries
1

Binding sites

1HT in 2 structures; the first of them:

  • 4J2T · Inhibitor-bound Ca2+ ATPase · 1HT A1001 · binds LYS252, GLU255, PHE256, GLN259, LEU260, VAL263, ILE267, ALA306 and 10 more
  • 4J2T · Inhibitor-bound CA2+ ATPase · 1HT A1001 · binds LYS252, GLU255, PHE256, GLN259, LEU260, VAL263, ILE267, ALA306 and 10 more

Residues it binds most

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

Found with

  • PTY · Phosphatidylethanolamine
  • K · Potassium ion

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