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MolNFT v1 · #175971 · protein

Cryo-EM structure of the prostaglandin E receptor EP4 coupled to G protein

7D7M · Prostaglandin E2 receptor EP4 SUBTYPE,PROSTAGLANDIN E2…: “Cryo-EM structure of the prostaglandin E receptor EP4 coupled to G protein”. Electron microscopy, 1 ligand (P2E), 16 pockets (best druggability 0.84). MolNFT v1 #175971 on…

PDB
7D7M
Type
protein
Length
1,031 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Prostaglandin E2 receptor EP4 SUBTYPE,PROSTAGLANDIN E2 receptor EP4 subtype; Guanine…
UniProt
P35408, P62873, P59768, P63092
Ligands
P2E
Pockets
16 · best druggability 0.84

Structure

electron microscopy · 5 distinct chains · 37% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProstaglandin E2 receptor EP4 SUBTYPE,PROSTAGLANDIN E2 receptor EP4 subtypeprotein28577% helix, 1% strandP35408
BGuanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1protein3367% helix, 40% strandP62873
CGuanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2protein5454% helix, 0% strandP59768
DGuanine nucleotide-binding protein G(S) subunit alpha isoforms SHORT,GUANINE nucleotide-binding protein G(S) subunit alpha isoforms SHORT,GUANINE nucleotide-binding protein G(S) subunit alpha isoforms shortprotein22845% helix, 13% strandP63092
ENanobody NB35protein1285% helix, 38% strand—

Ligands and binding sites

  • P2E · (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13780.840.9246P2E
26340.810.8652empty
310840.740.7769empty
45260.680.7970empty
51170.660.8926empty

Interfaces

6 interfaces between chains.

  • B–C · 1444 Ų buried · 1 hydrogen bond · protein-protein
  • B–D · 1419 Ų buried · 14 hydrogen bonds · protein-protein
  • A–D · 1378 Ų buried · 11 hydrogen bonds · protein-protein
  • D–E · 727 Ų buried · 8 hydrogen bonds · protein-protein
  • B–E · 396 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 7D7M · Cryo-EM Structure of the Prostaglandin E Receptor EP4 Coupled to G Protein · the same entry in another collection · chain E against E, 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
  • P35408 · AlphaFold monomer V2.0 prediction for prostaglandin E2 receptor EP4 subtype (P35408) · a predicted model of the same protein · chain A against A, TM-score 0.89
  • 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 0.83

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