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Ligand · YI4

YI4 · (1R,2Z,3R,5E,7E,9beta,17beta)-2-(2-hydroxyethylidene)-17-[(2R)-6-hydroxy-6-methylheptan-2-yl]-9-(prop-2-en-1-yl)-9,10-secoestra-5,7-diene-1,3-diol

YI4, (1R,2Z,3R,5E,7E,9beta,17beta)-2-(2-hydroxyethylidene)-17-[(2R)-6-hydroxy-6-methylheptan-2-yl]-9-(prop-2-en-1-yl)-9,10-secoestra-5,7-diene-1,3-diol (C31 H50 O4, 486.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
YI4
Formula
C31 H50 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

YI4 in 2 structures; the first of them:

  • 3VT9 · Crystal structures of rat VDR-LBD with W282R mutation · YI4 A500 · binds TYR143, ASP144, TYR147, PHE150, LEU223, LEU226, LEU229, VAL230 and 22 more
  • 3VT9 · Crystal structures of rat vdr-lbd with W282R mutation · YI4 A500 · binds TYR143, ASP144, TYR147, PHE150, LEU223, LEU226, LEU229, VAL230 and 22 more

Residues it binds most

LEU 2, TYR 2, PHE 2, SER 2, VAL 2, HIS 2, ILE 2, ALA 2, ARG 2, ASP 2 (residue and the binding sites it lines).

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