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MolNFT v1 · #186815 · protein

Cryo-EM structure of the full-length TRPV1 with rtx at 48 degrees celsius, in an open state, class alpha

7RQZ · Transient receptor potential cation channel subfamily V…: “Cryo-EM structure of the full-length TRPV1 with rtx at 48 degrees celsius, in an open state, class alpha”. Electron microscopy, 3 ligands (LBN, 6OU, 6EU), 20 pockets (best…

PDB
7RQZ
Type
protein
Length
2,128 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
LBN, 6OU, 6EU
Pockets
20 · best druggability 0.83

Structure

electron microscopy · 1 distinct chain · 58% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, B, DTransient receptor potential cation channel subfamily V member 1protein53258% helix, 3% strandO35433

Ligands and binding sites

  • LBN · 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine · ligand · 8 copies · chains A, C, B, D
  • 6OU · [(2~{R})-1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-hexadecanoyloxy-propan-2-yl] (~{Z})-octadec-9-enoate · ligand · 8 copies · chains A, C, B, D
  • 6EU · resiniferatoxin · ligand · 4 copies · chains A, C, B, 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
19700.830.8475empty
25860.780.8460LBN
35520.730.8175empty
45350.720.80516EU
55790.720.8074empty

Interfaces

4 interfaces between chains.

  • A–D · 2238 Ų buried · 8 hydrogen bonds · protein-protein
  • C–B · 2237 Ų buried · 8 hydrogen bonds · protein-protein
  • B–D · 2236 Ų buried · 8 hydrogen bonds · protein-protein
  • A–C · 2236 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 7RQZ · Cryo-EM structure of the full-length TRPV1 with RTx at 48 degrees Celsius, in an open… · 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 0.93

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