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Crystal structure of MAGI2 and dendrin complex

Analyse Crystal structure of MAGI2 and dendrin complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6JJZ
Type
protein
Length
210 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Membrane-associated guanylate kinase, ww and PDZ domain- containing protein 2; Peptide…
UniProt
Q9WVQ1, Q80TS7
Ligands
SO4
Pockets
1 · best druggability 0.30

Structure

x-ray diffraction · 3 distinct chains · 15% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMembrane-associated guanylate kinase, ww and PDZ domain- containing protein 2protein8817% helix, 32% strandQ9WVQ1
BMembrane-associated guanylate kinase, ww and PDZ domain- containing protein 2protein9616% helix, 29% strandQ9WVQ1
C, DPeptide from dendrinprotein130% helix, 0% strandQ80TS7

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains B
  • ACT · Acetate ion · additive · 2 copies · chains A, C, 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1670.300.7411empty

Interfaces

4 interfaces between chains.

  • A–C · 672 Ų buried · 6 hydrogen bonds · protein-protein
  • B–D · 662 Ų buried · 6 hydrogen bonds · protein-protein
  • A–B · 504 Ų buried · 9 hydrogen bonds · protein-protein
  • A–D · 123 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 6JJZ · Crystal Structure of MAGI2 and Dendrin complex · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9WVQ1 · AlphaFold monomer V2.0 prediction for membrane-associated guanylate kinase, ww and PDZ… · a predicted model of the same protein · chain A against A, TM-score 0.70
  • Q80TS7 · AlphaFold monomer V2.0 prediction for dendrin (Q80TS7) · a predicted model of the same protein · chain D against A, TM-score 0.33

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