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Oxidized dimeric PICK1 PDZ in complex with the carboxyl tail peptide of GLUR2

Analyse Oxidized dimeric PICK1 PDZ in complex with the carboxyl tail peptide of GLUR2 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3HPK
Type
protein
Length
219 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Prkca-binding PROTEIN,9-mer peptide of the GLUR2 subunit
UniProt
Q6GQQ2
Pockets
1 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 20% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APrkca-binding PROTEIN,9-mer peptide of the GLUR2 subunitprotein11220% helix, 36% strandQ6GQQ2
BPrkca-binding PROTEIN,9-mer peptide of the GLUR2 subunitprotein10720% helix, 35% strandQ6GQQ2

Ligands and binding sites

  • GOL · Glycerol · additive · chains B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13750.700.8248empty

Interfaces

1 interface between chains.

  • A–B · 964 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 3HPK · Oxidized dimeric PICK1 PDZ in complex with the carboxyl tail peptide of GluR2 · the same entry in another collection · chain A against A, TM-score 1.00

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