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MolNFT v1 · #143706 · protein

Structure of MGLUR3 with an agonist

6B7H · Metabotropic glutamate receptor 3: “Structure of MGLUR3 with an agonist”. X-ray diffraction, 3 ligands (CWY, NAG, CA), 4 pockets (best druggability 0.66). MolNFT v1 #143706 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6B7H
Type
protein
Length
441 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Metabotropic glutamate receptor 3
UniProt
Q14832
Ligands
CWY, NAG, CA
Pockets
4 · best druggability 0.66

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMetabotropic glutamate receptor 3protein44135% helix, 20% strandQ14832

Ligands and binding sites

  • CWY · (1S,2S,4S,5R,6S)-2-amino-4-[(3-methoxybenzene-1-carbonyl)amino]bicyclo[3.1.0]hexane-2,6-dicarboxylic acid · ligand · chains A
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 5 copies · chains A
  • CA · Calcium ion · metal · 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, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11940.660.8536CWY
2840.640.9019empty
33370.590.7738empty
4510.350.7917empty

Modifications

Observed in the structure: 3 disulfide, 3 glycan (disulfide, N-glycosylation).

Compared structures

  • 6B7H · Structure of mGluR3 with an agonist · the same entry in another collection · chain A against A, TM-score 1.00
  • Q14832 · AlphaFold monomer V2.0 prediction for metabotropic glutamate receptor 3 (Q14832) · a predicted model of the same protein · chain A against A, TM-score 0.96

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