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Structure of the delta opioid receptor bound to naltrindole

Analyse Structure of the delta opioid receptor bound to naltrindole in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4EJ4
Type
protein
Length
442 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Delta-type opioid receptor, lysozyme chimera
EC
3.2.1.17
UniProt
P32300, P00720
Ligands
EJ4
Pockets
4 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 74% helix, 7% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADelta-type opioid receptor, lysozyme chimera (EC 3.2.1.17)protein44274% helix, 7% strandP32300, P00720

Ligands and binding sites

  • EJ4 · (4bS,8R,8aS,14bR)-7-(cyclopropylmethyl)-5,6,7,8,14,14b-hexahydro-4,8-methano[1]benzofuro[2,3-a]pyrido[4,3-b]carbazole-1,8a(9H)-diol · ligand · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16640.730.7951EJ4
21150.380.7419empty
3890.350.7415empty
4690.320.7418empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 4EJ4 · Structure of the delta opioid receptor bound to naltrindole · the same entry in another collection · chain A against A, TM-score 1.00
  • P32300 · AlphaFold monomer V2.0 prediction for delta-type opioid receptor (P32300) · a predicted model of the same protein · chain A against A, TM-score 0.62

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