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Structure of GluA2o ligand-binding domain (S1S2J) in complex with glutamate and sodium bromide at 1.95 A resolution

Analyse Structure of GluA2o ligand-binding domain (S1S2J) in complex with glutamate and… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6GL4
Type
protein
Length
526 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.948
Source
Rattus norvegicus
Molecule
Glutamate receptor 2,Glutamate receptor 2
UniProt
P19491
Ligands
GLU, NA, BR
Pockets
4 · best druggability 0.72

Structure

x-ray diffraction · resolution 1.948 · 1 distinct chain · 38% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BGlutamate receptor 2,Glutamate receptor 2protein26338% helix, 21% strandP19491

Ligands and binding sites

  • GLU · Glutamic acid · ligand · 2 copies · chains A, B
  • NA · Sodium ion · metal · 2 copies · chains B
  • BR · Bromide ion · ion · 6 copies · chains A, B
  • GOL · Glycerol · additive · chains A
  • ACT · Acetate ion · additive · chains B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

4 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18590.720.7768BR
21150.430.7725empty
3810.370.7723empty
4540.370.8017BR

Interfaces

1 interface between chains.

  • A–B · 348 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 6GL4 · Structure of GLUA2O ligand-binding domain (S1S2J) in complex with glutamate and sodium… · the same entry in another collection · chain A against A, TM-score 1.00
  • P19491 · AlphaFold monomer V2.0 prediction for glutamate receptor 2 (P19491) · a predicted model of the same protein · chain A against A, TM-score 0.97

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