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The PDZ domain of SNTG1 complexed with the acetylated PDZ-binding motif of TRPV3

Analyse The PDZ domain of SNTG1 complexed with the acetylated PDZ-binding motif of TRPV3 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7QQN
Type
protein
Length
838 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Gamma-1-SYNTROPHIN,ANNEXIN A2; Transient receptor potential cation channel subfamily V…
UniProt
Q9NSN8, P07355, Q8NET8
Ligands
CA
Pockets
7 · best druggability 0.76

Structure

x-ray diffraction · 4 distinct chains · 58% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGamma-1-SYNTROPHIN,ANNEXIN A2protein41358% helix, 10% strandQ9NSN8, P07355
CGamma-1-SYNTROPHIN,ANNEXIN A2protein41460% helix, 9% strandQ9NSN8, P07355
BTransient receptor potential cation channel subfamily V member 3protein50% helix, 60% strandQ8NET8
DTransient receptor potential cation channel subfamily V member 3protein60% helix, 33% strandQ8NET8

Ligands and binding sites

  • CA · Calcium ion · metal · 9 copies · chains A, C
  • GOL · Glycerol · additive · chains C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19750.760.7898CA
22170.560.7930empty
31100.490.8123GOL
42700.480.7332empty
51810.470.7624empty

Interfaces

3 interfaces between chains.

  • C–D · 476 Ų buried · 12 hydrogen bonds · protein-protein
  • A–B · 439 Ų buried · 15 hydrogen bonds · protein-protein
  • A–C · 437 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 7QQN · The PDZ domain of SNTG1 complexed with the acetylated PDZ-binding motif of TRPV3 · the same entry in another collection · chain A against A, TM-score 1.00
  • P07355 · AlphaFold monomer V2.0 prediction for annexin A2 (P07355) · a predicted model of the same protein · chain A against A, TM-score 0.78
  • Q8NET8 · AlphaFold monomer V2.0 prediction for transient receptor potential cation channel… · a predicted model of the same protein · chain B against A, TM-score 0.71
  • Q9NSN8 · AlphaFold monomer V2.0 prediction for gamma-1-syntrophin (Q9NSN8) · a predicted model of the same protein · chain A against A, TM-score 0.29

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