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Cryo-EM structure of mouse TRPV3 in complex with 2-aminoethoxydiphenyl borate (2-apb)

Analyse Cryo-EM structure of mouse TRPV3 in complex with 2-aminoethoxydiphenyl borate… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6DVY
Type
protein
Length
2,564 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transient receptor potential cation channel subfamily V member 3
UniProt
Q8K424
Ligands
FZ4
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 1 distinct chain · 52% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DTransient receptor potential cation channel subfamily V member 3protein64152% helix, 3% strandQ8K424

Ligands and binding sites

  • FZ4 · 2-aminoethyl diphenylborinate · ligand · 8 copies · chains A, B, C, D

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

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111030.860.8693empty
22470.720.8627FZ4
32440.710.8628FZ4
42590.700.8427FZ4
52460.690.8530FZ4

Interfaces

6 interfaces between chains.

  • A–D · 3032 Ų buried · 18 hydrogen bonds · protein-protein
  • A–B · 3031 Ų buried · 18 hydrogen bonds · protein-protein
  • C–D · 3022 Ų buried · 18 hydrogen bonds · protein-protein
  • B–C · 3018 Ų buried · 18 hydrogen bonds · protein-protein
  • A–C · 23 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 covalent (covalent ligand).

Compared structures

  • 6DVY · Cryo-EM structure of mouse TRPV3 in complex with 2-Aminoethoxydiphenyl borate (2-APB) · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8K424 · AlphaFold monomer V2.0 prediction for transient receptor potential cation channel… · a predicted model of the same protein · chain A against A, TM-score 0.92

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