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MolNFT v1 · #177980 · protein

Cryo-EM structure of dopamine receptor 1 and mini-gs complex with dopamine bound

7F0T · D(1A) dopamine receptor: “Cryo-EM structure of dopamine receptor 1 and mini-gs complex with dopamine bound”. Electron microscopy, 1 ligand (LDP), 13 pockets (best druggability 0.80). MolNFT v1 #177980 on GenesisL1: 3D structure…

PDB
7F0T
Type
protein
Length
1,033 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
D(1A) dopamine receptor; Guanine nucleotide-binding protein G(S) subunit alpha isoforms…
UniProt
P21728, P63092, P62873, P59768
Ligands
LDP
Pockets
13 · best druggability 0.80

Structure

electron microscopy · 5 distinct chains · 40% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
FD(1A) dopamine receptorprotein28284% helix, 1% strandP21728
AGuanine nucleotide-binding protein G(S) subunit alpha isoforms SHORT,ISOFORM gnas-2 of guanine nucleotide-binding protein G(S) subunit alpha isoforms shortprotein22849% helix, 17% strandP63092
BGuanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1protein3399% helix, 47% strandP62873
DGuanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2protein5657% helix, 0% strandP59768
ENANOBODY35protein1282% helix, 41% strand—

Ligands and binding sites

  • LDP · L-dopamine · ligand · chains F

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

Pockets

13 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16310.800.8554empty
210910.760.7972empty
39230.750.7863empty
45090.740.8255empty
52830.660.8236LDP

Interfaces

6 interfaces between chains.

  • B–D · 2288 Ų buried · 18 hydrogen bonds · protein-protein
  • F–A · 1721 Ų buried · 10 hydrogen bonds · protein-protein
  • A–B · 1483 Ų buried · 23 hydrogen bonds · protein-protein
  • A–E · 788 Ų buried · 9 hydrogen bonds · protein-protein
  • B–E · 608 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 7F0T · Cryo-EM structure of dopamine receptor 1 and mini-Gs complex with dopamine bound · 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 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 D against A, TM-score 0.94
  • P21728 · AlphaFold monomer V2.0 prediction for D(1A) dopamine receptor (P21728) · a predicted model of the same protein · chain F against A, TM-score 0.89

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