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MolNFT v1 · #180538 · protein

Cryo-EM structure of rtx-bound minimal TRPV1 with nmdg at state B

7L2V · Transient receptor potential cation channel subfamily V…: “Cryo-EM structure of rtx-bound minimal TRPV1 with nmdg at state B”. Electron microscopy, 3 ligands (6EU, XPS, NA), 20 pockets (best druggability 0.83). MolNFT v1 #180538 on…

PDB
7L2V
Type
protein
Length
2,144 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, XPS, NA
Pockets
20 · best druggability 0.83

Structure

electron microscopy · 1 distinct chain · 57% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D, B, CTransient receptor potential cation channel subfamily V member 1protein53657% helix, 4% strandO35433

Ligands and binding sites

  • 6EU · resiniferatoxin · ligand · 4 copies · chains A, D, C, B
  • XPS · 6-deoxy-6-(methylamino)-D-galactitol · ligand · chains D, B, C
  • NA · Sodium ion · metal · 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
110580.830.8495XPS, NA
210240.810.8274empty
39960.810.8272empty
49320.810.8270empty
58560.790.8272empty

Interfaces

4 interfaces between chains.

  • A–B · 2285 Ų buried · 10 hydrogen bonds · protein-protein
  • A–D · 2260 Ų buried · 12 hydrogen bonds · protein-protein
  • D–C · 2230 Ų buried · 10 hydrogen bonds · protein-protein
  • B–C · 2196 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 7L2V · cryo-EM structure of RTX-bound minimal TRPV1 with NMDG at state b · 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 0.92

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