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Ligand · 4D8

4D8 · (3beta,4alpha,5beta,14beta)-3-hydroxy-4-methylcholesta-8,24-diene-4-carboxylic acid

4D8, (3beta,4alpha,5beta,14beta)-3-hydroxy-4-methylcholesta-8,24-diene-4-carboxylic acid (C29 H46 O3, 442.7 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5…

Component
4D8
Formula
C29 H46 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

4D8 in 4 structures; the first of them:

  • 4S14 · Crystal structure of the orphan nuclear receptor RORgamma ligand-binding domain in… · 4D8 A900 · binds GLN286, LEU287, TRP317, CYS320, HIS323, LEU324, ALA327, VAL361 and 12 more
  • 4S15 · Crystal structure of the orphan nuclear receptor RORalpha ligand-binding domain in… · 4D8 A601 · binds GLN289, TYR290, TRP320, CYS323, LYS326, ILE327, ALA330, VAL364 and 15 more
  • 4S14 · Crystal structure of the orphan nuclear receptor rorgamma ligand- binding domain in… · 4D8 A900 · binds GLN286, LEU287, TRP317, CYS320, HIS323, LEU324, ALA327, VAL361 and 12 more
  • 4S15 · Crystal structure of the orphan nuclear receptor roralpha ligand- binding domain in… · 4D8 A601 · binds GLN289, TYR290, TRP320, CYS323, LYS326, ILE327, ALA330, VAL364 and 15 more

Residues it binds most

PHE 6, VAL 6, ALA 6, ILE 6, TYR 6, LEU 6, CYS 6, HIS 6, ARG 6, GLN 6 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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