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MolNFT v1 · #182638 · protein

Cryo-EM structure of minimal TRPV1 with rtx bound in C2 state

7MZD · Transient receptor potential cation channel subfamily V…: “Cryo-EM structure of minimal TRPV1 with rtx bound in C2 state”. Electron microscopy, 2 ligands (6EU, NA), 20 pockets (best druggability 0.88). MolNFT v1 #182638 on…

PDB
7MZD
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
6EU, NA
Pockets
20 · best druggability 0.88

Structure

electron microscopy · 1 distinct chain · 58% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D, B, CTransient receptor potential cation channel subfamily V member 1protein53258% helix, 4% strandO35433

Ligands and binding sites

  • 6EU · resiniferatoxin · ligand · 4 copies · chains A, D, C, B
  • NA · Sodium ion · metal · 2 copies · chains A, D, B, C

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
19860.880.8883NA
21540.740.9120empty
33360.700.8335empty
43390.700.8235empty
53270.690.8330empty

Interfaces

6 interfaces between chains.

  • A–B · 2714 Ų buried · 9 hydrogen bonds · protein-protein
  • A–D · 2695 Ų buried · 11 hydrogen bonds · protein-protein
  • B–C · 2688 Ų buried · 10 hydrogen bonds · protein-protein
  • D–C · 2682 Ų buried · 13 hydrogen bonds · protein-protein
  • D–B · 29 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7MZD · Cryo-EM structure of minimal TRPV1 with RTX bound in C2 state · 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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