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Ligand · GY1

GY1 · 2-[3-[(1~{R})-1-[(2~{S})-1-[(2~{S})-2-cyclohexyl-2-(3,4,5-trimethoxyphenyl)ethanoyl]piperidin-2-yl]carbonyloxy-3-(3,4-dimethoxyphenyl)propyl]phenoxy]ethanoic acid

GY1, 2-[3-[(1~{R})-1-[(2~{S})-1-[(2~{S})-2-cyclohexyl-2-(3,4,5-trimethoxyphenyl)ethanoyl]piperidin-2-yl]carbonyloxy-3-(3,4-dimethoxyphenyl)propyl]phenoxy]ethanoic acid (C42 H53 N O11, 747.9 g/mol), in the MolNFT structures on GenesisL1…

Component
GY1
Formula
C42 H53 N O11
Class
ligand
Structures
2
PDB entries
2

Binding sites

GY1 in 2 structures; the first of them:

  • 7R0L · Structure of the FK1 domain of the FKBP51 G64S variant in complex with SAFit1 · GY1 A201 · binds TYR57, GLY59, LYS60, LEU61, LYS66, ASP68, SER70, PHE77 and 14 more
  • 8PJ8 · FKBP51FK1 F67E/K60Orn (i, i+7) in complex with SAFit1 · GY1 A201 · binds TYR57, GLY59, ORN60, LEU61, LYS66, ASP68, ARG73, PHE77 and 14 more

Residues it binds most

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

Found with

  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid
  • GOL · Glycerol

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