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Ligand · SHI

SHI · (S)-2-amino-3-(3-hydroxy-isoxazol-4-yl)propionic acid

SHI, (S)-2-amino-3-(3-hydroxy-isoxazol-4-yl)propionic acid (C6 H8 N2 O4, 172.1 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
SHI
Formula
C6 H8 N2 O4
Class
ligand
Structures
4
PDB entries
2

Binding sites

SHI in 4 structures; the first of them:

  • 1MQD · X-ray structure of the GluR2 ligand-binding core (S1S2J) in complex with (S)-Des-Me-AMPA… · SHI A3001 · binds GLU10, TYR58, PRO86, LEU87, THR88, ARG93, LEU135, GLY138 and 7 more
  • 1MS7 · X-ray structure of the GluR2 ligand-binding core (S1S2J) in complex with (S)-Des-Me-AMPA… · SHI A2001 · binds TYR58, PRO86, LEU87, THR88, ARG93, LEU135, GLY138, SER139 and 6 more
  • 1MQD · X-ray structure of the GLUR2 ligand-binding core (S1S2J) in complex with (S)-des-me-AMPA… · SHI A3001 · binds GLU10, TYR58, PRO86, LEU87, THR88, ARG93, LEU135, GLY138 and 7 more
  • 1MS7 · X-ray structure of the GLUR2 ligand-binding core (S1S2J) in complex with (S)-des-me-AMPA… · SHI A2001 · binds TYR58, PRO86, LEU87, THR88, ARG93, LEU135, GLY138, SER139 and 6 more

Residues it binds most

LEU 14, THR 14, TYR 14, GLU 14, ARG 14, GLY 14, MET 14, PRO 14, SER 14 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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