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Cryo-EM structure of GPR52-minigs-NB35

Analyse Cryo-EM structure of GPR52-minigs-NB35 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6LI3
Type
protein
Length
1,045 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
G-protein coupled receptor 52; Guanine nucleotide-binding protein G(S) subunit alpha…
UniProt
Q9Y2T5, P63092, P62873, P59768
Pockets
15 · best druggability 0.80

Structure

electron microscopy · 5 distinct chains · 36% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
RG-protein coupled receptor 52protein28479% helix, 0% strandQ9Y2T5
AGuanine nucleotide-binding protein G(S) subunit alpha isoforms shortprotein24041% helix, 14% strandP63092
BGuanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1protein3387% helix, 45% strandP62873
GGuanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2protein5751% helix, 0% strandP59768
NNanobody NB35protein1262% helix, 42% strand—

Pockets

15 pockets found on a 1 Å grid, 11 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16490.800.8553empty
210560.790.8081empty
310330.760.7958empty
43610.730.8446empty
54400.720.8343empty

Interfaces

7 interfaces between chains.

  • B–G · 2115 Ų buried · 16 hydrogen bonds · protein-protein
  • R–A · 1491 Ų buried · 6 hydrogen bonds · protein-protein
  • A–B · 1477 Ų buried · 9 hydrogen bonds · protein-protein
  • A–N · 771 Ų buried · 3 hydrogen bonds · protein-protein
  • B–N · 550 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 6LI3 · cryo-EM structure of GPR52-miniGs-NB35 · the same entry in another collection · chain N against N, TM-score 1.00
  • P62873 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(I)/G(S)/G(T)… · a predicted model of the same protein · chain B against A, TM-score 0.99
  • Q9Y2T5 · AlphaFold monomer V2.0 prediction for G-protein coupled receptor 52 (Q9Y2T5) · a predicted model of the same protein · chain R against A, TM-score 0.92
  • P59768 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(I)/G(S)/G(O)… · a predicted model of the same protein · chain G against A, TM-score 0.84
  • P63092 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(S) subunit… · a predicted model of the same protein · chain A against A, TM-score 0.82

Analyse

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