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Crystal structure of eed in complex with 3-(3-METHOXYBENZYL)PIPERIDINE hydrochloride

Analyse Crystal structure of eed in complex with 3-(3-METHOXYBENZYL)PIPERIDINE… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5U5K
Type
protein
Length
358 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Polycomb protein eed
UniProt
O75530
Ligands
7VY
Pockets
4 · best druggability 0.76

Structure

x-ray diffraction · 1 distinct chain · 3% helix, 47% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APolycomb protein eedprotein3583% helix, 47% strandO75530

Ligands and binding sites

  • 7VY · (3R)-3-[(3-methoxyphenyl)methyl]piperidine · ligand · chains A
  • FMT · Formic acid · additive · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14210.760.8550empty
2930.550.85127VY
3760.340.7517empty
4560.270.7312empty

Compared structures

  • 5U5K · Crystal structure of EED in complex with 3-(3-methoxybenzyl)piperidine hydrochloride · the same entry in another collection · chain A against A, TM-score 1.00
  • O75530 · AlphaFold monomer V2.0 prediction for polycomb protein eed (O75530) · a predicted model of the same protein · chain A against A, TM-score 0.99

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