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MolNFT v1 · #190317 · protein

Cryo-EM structure of the adhesion GPCR ADGRD1 in complex with minigs

7WU2 · Guanine nucleotide-binding protein G(S) subunit alpha…: “Cryo-EM structure of the adhesion GPCR ADGRD1 in complex with minigs”. Electron microscopy, 10 pockets (best druggability 0.84). MolNFT v1 #190317 on GenesisL1: 3D structure…

PDB
7WU2
Type
protein
Length
1,010 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Guanine nucleotide-binding protein G(S) subunit alpha isoforms short; Guanine…
UniProt
P62873, P59768, Q6QNK2
Pockets
10 · best druggability 0.84

Structure

electron microscopy · 5 distinct chains · 36% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGuanine nucleotide-binding protein G(S) subunit alpha isoforms shortprotein21043% helix, 18% strand—
BGuanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1protein3398% helix, 46% strandP62873
CGuanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2protein5659% helix, 0% strandP59768
NNanobody NB35protein1285% helix, 47% strand—
RAdhesion G-protein coupled receptor D1protein27773% helix, 1% strandQ6QNK2

Pockets

10 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18650.840.8684empty
29490.750.7868empty
37670.740.7954empty
44340.670.8055empty
52010.550.7931empty

Interfaces

6 interfaces between chains.

  • B–C · 2161 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 1242 Ų buried · 13 hydrogen bonds · protein-protein
  • A–R · 1079 Ų buried · 5 hydrogen bonds · protein-protein
  • A–N · 770 Ų buried · 10 hydrogen bonds · protein-protein
  • B–N · 555 Ų buried · 10 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 7WU2 · Cryo-EM structure of the adhesion GPCR ADGRD1 in complex with miniGs · 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 0.99
  • Q6QNK2 · AlphaFold monomer V2.0 prediction for adhesion G-protein coupled receptor D1 (Q6QNK2) · a predicted model of the same protein · chain R against A, TM-score 0.93
  • 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 C against A, TM-score 0.91

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