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MolNFT v1 · #186811 · protein

Cryo-EM structure of the full-length TRPV1 with rtx at 4 degrees celsius, in an intermediate-closed state, class II

7RQV · Transient receptor potential cation channel subfamily V…: “Cryo-EM structure of the full-length TRPV1 with rtx at 4 degrees celsius, in an intermediate-closed state…”. Electron microscopy, 4 ligands (6OU, LBN, 6EU), 20 pockets (best…

PDB
7RQV
Type
protein
Length
2,320 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transient receptor potential cation channel subfamily V member 1
UniProt
O35433
Ligands
6OU, LBN, 6EU, NA
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 1 distinct chain · 53% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, D, BTransient receptor potential cation channel subfamily V member 1protein58053% helix, 4% strandO35433

Ligands and binding sites

  • 6OU · [(2~{R})-1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-hexadecanoyloxy-propan-2-yl] (~{Z})-octadec-9-enoate · ligand · 12 copies · chains A, D, B, C
  • LBN · 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine · ligand · 4 copies · chains A, C, D, B
  • 6EU · resiniferatoxin · ligand · 4 copies · chains A, D, C, B
  • NA · Sodium ion · metal · 2 copies · chains A, C, D, B

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
16790.840.8851NA
26980.780.8262LBN
36640.780.8359LBN
46550.770.8257LBN
56300.760.8257LBN

Interfaces

4 interfaces between chains.

  • A–B · 2476 Ų buried · 8 hydrogen bonds · protein-protein
  • A–D · 2475 Ų buried · 7 hydrogen bonds · protein-protein
  • C–B · 2474 Ų buried · 7 hydrogen bonds · protein-protein
  • C–D · 2472 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 7RQV · Cryo-EM structure of the full-length TRPV1 with RTx at 4 degrees Celsius, in an… · the same entry in another collection · chain A against A, TM-score 1.00
  • O35433 · AlphaFold monomer V2.0 prediction for transient receptor potential cation channel… · a predicted model of the same protein · chain A against A, TM-score 0.96

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