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Ligand · 754

754 · (2E,4E,6Z)-3-methyl-7-(5,5,8,8-tetramethyl-3-propoxy-5, 6,7,8-tetrahydronaphthalen-2-yl)octa-2,4,6-trienoic acid

754, (2E,4E,6Z)-3-methyl-7-(5,5,8,8-tetramethyl-3-propoxy-5, 6,7,8-tetrahydronaphthalen-2-yl)octa-2,4,6-trienoic acid (C26 H36 O3, 396.6 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site…

Component
754
Formula
C26 H36 O3
Class
ligand
Structures
3
PDB entries
2

Binding sites

754 in 3 structures; the first of them:

  • 6SSQ · Crystal structure of RARbeta LBD in complex with LG 100754 · 754 A501 · binds PHE192, TRP218, PHE221, LEU224, ALA225, CYS228, LEU259, LEU262 and 17 more
  • 6SSQ · Crystal structure of rarbeta lbd in complex with lg 100754 · 754 A501 · binds PHE192, PHE221, LEU224, ALA225, CYS228, LEU259, LEU262, ILE263 and 13 more
  • 6STI · Crystal structure of rxralpha lbd in complex with lg 100754 and a coactivator peptide · 754 A501 · binds ILE268, CYS269, ALA271, ALA272, GLN275, ASN306, ILE310, PHE313 and 11 more

Residues it binds most

LEU 5, ILE 5, PHE 5, ARG 5, CYS 5, GLY 4, VAL 5, ALA 4, MET 3, SER 4 (residue and the binding sites it lines).

Found with

  • FLC · Citrate anion
  • GOL · Glycerol
  • ACT · Acetate ion

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