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MolNFT v1 · #66415 · protein

Oxidized dimeric PICK1 PDZ C46G mutant in complex with the carboxyl tail peptide of GLUR2

3HPM · Prkca-binding PROTEIN,9-mer peptide of the GLUR2 subunit: “Oxidized dimeric PICK1 PDZ C46G mutant in complex with the carboxyl tail peptide of GLUR2”. X-ray diffraction, 4 pockets (best druggability 0.53). MolNFT v1 #66415 on…

PDB
3HPM
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
4 · best druggability 0.53

Structure

x-ray diffraction · 2 distinct chains · 20% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APrkca-binding PROTEIN,9-mer peptide of the GLUR2 subunitprotein10820% helix, 33% strandQ6GQQ2
BPrkca-binding PROTEIN,9-mer peptide of the GLUR2 subunitprotein11120% helix, 32% strandQ6GQQ2

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11650.530.7926empty
21850.520.7836empty
3860.420.7918empty
4770.410.7919empty

Interfaces

1 interface between chains.

  • A–B · 885 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 3HPM · Oxidized dimeric PICK1 PDZ C46G mutant 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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