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MolNFT v1 · #187106 · protein

EX4-D-ala bound to the glucagon-like peptide-1 RECEPTOR/G protein complex (conformer 1)

7S1M · Guanine nucleotide-binding protein G(S) subunit alpha…: “EX4-D-ala bound to the glucagon-like peptide-1 RECEPTOR/G protein complex (conformer 1)”. Electron microscopy, 14 pockets (best druggability 0.82). MolNFT v1 #187106 on…

PDB
7S1M
Type
protein
Length
1,169 residues
Chains
6
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Guanine nucleotide-binding protein G(S) subunit alpha isoforms short; Guanine…
UniProt
P63092, P62873, P59768, P43220
Pockets
14 · best druggability 0.82

Structure

electron microscopy · 6 distinct chains · 40% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGuanine nucleotide-binding protein G(S) subunit alpha isoforms shortprotein23349% helix, 18% strandP63092
BGuanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1protein3408% helix, 48% strandP62873
GGuanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2protein5860% helix, 0% strandP59768
NNB35protein1287% helix, 44% strand—
PEX4-D-alaprotein2993% helix, 0% strand—
RGlucagon-like peptide 1 receptorprotein38169% helix, 4% strandP43220

Pockets

14 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16770.820.8656empty
28970.760.8065empty
39950.760.7877empty
45360.700.8068empty
51160.660.9025empty

Interfaces

7 interfaces between chains.

  • B–G · 2213 Ų buried · 25 hydrogen bonds · protein-protein
  • P–R · 1674 Ų buried · 17 hydrogen bonds · protein-protein
  • A–B · 1496 Ų buried · 28 hydrogen bonds · protein-protein
  • A–R · 1035 Ų buried · 10 hydrogen bonds · protein-protein
  • A–N · 981 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide, 1 d-amino (disulfide, D-amino acid).

Compared structures

  • 7S1M · Ex4-D-Ala bound to the glucagon-like peptide-1 receptor/g protein complex (conformer 1) · the same entry in another collection · chain R against R, 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 1.00
  • 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 0.93
  • P43220 · AlphaFold monomer V2.0 prediction for glucagon-like peptide 1 receptor (P43220) · a predicted model of the same protein · chain R against A, TM-score 0.79

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