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Human metabotropic GABA(B) receptor in its apo state

Analyse Human metabotropic GABA(B) receptor in its apo state in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6VJM
Type
protein
Length
1,369 residues
Chains
2
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Gamma-aminobutyric acid type B receptor subunit 1; Gamma-aminobutyric acid type B…
UniProt
Q9UBS5, O75899
Ligands
NAG, FUC
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 2 distinct chains · 48% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGamma-aminobutyric acid type B receptor subunit 1protein68446% helix, 14% strandQ9UBS5
BGamma-aminobutyric acid type B receptor subunit 2protein68549% helix, 13% strandO75899

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 10 copies · chains A, B
  • FUC · alpha-L-fucopyranose · sugar · chains A

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

Pockets

20 pockets found on a 1 Å grid, 12 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111720.860.87108empty
210940.840.85111empty
31890.750.9033empty
43320.690.8241empty
51310.680.8929empty

Interfaces

1 interface between chains.

  • A–B · 1008 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 7 disulfide, 6 glycan (disulfide, N-glycosylation).

Compared structures

  • 6VJM · Human metabotropic GABA(B) receptor in its apo state · the same entry in another collection · chain A against A, TM-score 1.00
  • O75899 · AlphaFold monomer V2.0 prediction for gamma-aminobutyric acid type B receptor subunit 2… · a predicted model of the same protein · chain B against A, TM-score 0.92
  • Q9UBS5 · AlphaFold monomer V2.0 prediction for gamma-aminobutyric acid type B receptor subunit 1… · a predicted model of the same protein · chain A against A, TM-score 0.82

Analyse

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