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MolNFT v1 · #16964 · protein

Structure of acetylcholine receptor pore from electron images

1OED · Acetylcholine receptor subunit alpha: “Structure of acetylcholine receptor pore from electron images”. Electron microscopy, 8 pockets (best druggability 0.86). MolNFT v1 #16964 on GenesisL1: 3D structure, binding sites and pockets…

PDB
1OED
Type
protein
Length
636 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Acetylcholine receptor subunit alpha; Acetylcholine receptor beta subunit; Acetylcholine…
UniProt
P02711, Q6S3I0, Q6S3H8, Q6S3H9
Pockets
8 · best druggability 0.86

Structure

electron microscopy · 4 distinct chains · 87% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DAcetylcholine receptor subunit alphaprotein12791% helix, 0% strandP02711
BAcetylcholine receptor beta subunitprotein12786% helix, 0% strandQ6S3I0
CAcetylcholine receptor delta subunitprotein12787% helix, 0% strandQ6S3H8
EAcetylcholine receptor gamma subunitprotein12885% helix, 0% strandQ6S3H9

Pockets

8 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110740.860.86115empty
23610.840.9254empty
34290.820.8942empty
411030.810.8293empty
51780.750.9036empty

Interfaces

5 interfaces between chains.

  • D–E · 860 Ų buried · 2 hydrogen bonds · protein-protein
  • A–E · 791 Ų buried · 5 hydrogen bonds · protein-protein
  • B–C · 783 Ų buried · 1 hydrogen bond · protein-protein
  • A–B · 691 Ų buried · 13 hydrogen bonds · protein-protein
  • C–D · 673 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 1OED · Structure of acetylcholine receptor pore from electron images · the same entry in another collection · chain B against B, TM-score 1.00
  • P02711 · AlphaFold monomer V2.0 prediction for acetylcholine receptor subunit alpha (P02711) · a predicted model of the same protein · chain A against A, TM-score 0.74

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