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Ligand · 0VQ

0VQ · (3E,5E)-6-(3-{2-[3,4-bis(hydroxymethyl)phenyl]ethyl}phenyl)-1,1,1-trifluoro-2-(trifluoromethyl)octa-3,5-dien-2-ol

0VQ, (3E,5E)-6-(3-{2-[3,4-bis(hydroxymethyl)phenyl]ethyl}phenyl)-1,1,1-trifluoro-2-(trifluoromethyl)octa-3,5-dien-2-ol (C25 H26 F6 O3, 488.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding…

Component
0VQ
Formula
C25 H26 F6 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

0VQ in 4 structures; the first of them:

  • 4G2H · Structural basis for the accommodation of bis- and tris-aromatic derivatives in Vitamin D… · 0VQ A501 · binds TYR175, TYR179, PHE182, LEU255, LEU258, ALA259, LEU261, VAL262 and 22 more
  • 4G2I · Structural basis for the accommodation of bis- and tris-aromatic derivatives in Vitamin D… · 0VQ A501 · binds TYR143, TYR147, PHE150, LEU227, LEU230, ALA231, LEU233, VAL234 and 21 more
  • 4G2H · Structural basis for the accommodation of bis- and tris-aromatic derivatives in vitamin D… · 0VQ A501 · binds TYR175, TYR179, PHE182, LEU255, LEU258, ALA259, LEU261, VAL262 and 22 more
  • 4G2I · Structural basis for the accommodation of bis- and tris-aromatic derivatives in vitamin D… · 0VQ A501 · binds TYR143, TYR147, PHE150, LEU227, LEU230, ALA231, LEU233, VAL234 and 21 more

Residues it binds most

LEU 4, TYR 4, SER 4, VAL 4, ALA 4, HIS 4, ILE 4, PHE 4, ARG 4, CYS 4 (residue and the binding sites it lines).

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