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MolNFT v1 · #190275 · protein

Mouse TRPM8 in lmng in the presence of calcium, icilin and PI(4,5)P2

7WRC · Transient receptor potential cation channel subfamily M…: “Mouse TRPM8 in lmng in the presence of calcium, icilin and PI(4,5)P2”. Electron microscopy, 2 ligands (KX7, CA), 20 pockets (best druggability 0.84). MolNFT v1 #190275 on…

PDB
7WRC
Type
protein
Length
3,720 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transient receptor potential cation channel subfamily M member 8
UniProt
Q8R4D5
Ligands
KX7, CA
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 1 distinct chain · 62% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DTransient receptor potential cation channel subfamily M member 8protein93062% helix, 5% strandQ8R4D5

Ligands and binding sites

  • KX7 · Icilin · ligand · 4 copies · chains A, B, C, D
  • CA · Calcium ion · metal · 4 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
15430.840.9034empty
29460.800.8178CA, KX7
39180.800.8180KX7
48670.800.8277KX7
58050.790.8266KX7

Interfaces

6 interfaces between chains.

  • A–B · 4030 Ų buried · 29 hydrogen bonds · protein-protein
  • A–D · 3949 Ų buried · 29 hydrogen bonds · protein-protein
  • B–C · 3899 Ų buried · 24 hydrogen bonds · protein-protein
  • C–D · 3895 Ų buried · 26 hydrogen bonds · protein-protein
  • A–C · 38 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 7WRC · Mouse TRPM8 in LMNG in the presence of calcium, icilin and PI(4,5)P2 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8R4D5 · AlphaFold monomer V2.0 prediction for transient receptor potential cation channel… · a predicted model of the same protein · chain A against A, TM-score 0.89

Analyse

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