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Electrophorus electricus acetylcholinesterase

Analyse Electrophorus electricus acetylcholinesterase in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1C2O
Type
protein
Length
2,156 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Acetylcholinesterase
EC
3.1.1.7
UniProt
P21836
Pockets
20 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DAcetylcholinesterase (EC 3.1.1.7)protein53936% helix, 17% strandP21836

Pockets

20 pockets found on a 1 Å grid, 16 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12560.740.8835empty
22590.720.8636empty
33980.700.8248empty
44100.700.8148empty
53190.600.7849empty

Interfaces

4 interfaces between chains.

  • B–C · 912 Ų buried · 6 hydrogen bonds · protein-protein
  • A–D · 910 Ų buried · 4 hydrogen bonds · protein-protein
  • C–D · 363 Ų buried · 1 hydrogen bond · protein-protein
  • A–B · 362 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 12 disulfide (disulfide).

Compared structures

  • 1C2O · Electrophorus electricus acetylcholinesterase · the same entry in another collection · chain A against A, TM-score 1.00
  • P21836 · AlphaFold monomer V2.0 prediction for acetylcholinesterase (P21836) · a predicted model of the same protein · chain A against A, TM-score 1.00

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