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Crystal structure of the third PDZ domain of psd-95 protein D332P mutant: space group C121, structure 2

Analyse Crystal structure of the third PDZ domain of psd-95 protein D332P mutant: space… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6QJG
Type
protein
Length
388 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Disks large homolog 4
UniProt
P78352
Pockets
4 · best druggability 0.69

Structure

x-ray diffraction · 4 distinct chains · 20% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADisks large homolog 4protein9719% helix, 36% strandP78352
BDisks large homolog 4protein9619% helix, 36% strandP78352
CDisks large homolog 4protein9821% helix, 38% strandP78352
DDisks large homolog 4protein9721% helix, 36% strandP78352

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16360.690.7746empty
24570.610.7535empty
31720.490.7728empty
4980.390.7619empty

Interfaces

4 interfaces between chains.

  • B–D · 640 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 548 Ų buried · 4 hydrogen bonds · protein-protein
  • A–B · 317 Ų buried · 8 hydrogen bonds · protein-protein
  • A–D · 278 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 6QJG · Crystal Structure of the third PDZ domain of PSD-95 protein D332P mutant: space group… · the same entry in another collection · chain D against D, TM-score 1.00
  • P78352 · AlphaFold monomer V2.0 prediction for disks large homolog 4 (P78352) · a predicted model of the same protein · chain D against A, TM-score 0.96

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