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MolNFT v1 · #143517 · protein

Crystal structure of a complex between G protein beta gamma dimer and an inhibitory nanobody regulator

6B20 · Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit…: “Crystal structure of a complex between G protein beta gamma dimer and an inhibitory nanobody regulator”. X-ray diffraction, 2 ligands (UNX, CL), 8 pockets (best…

PDB
6B20
Type
protein
Length
1,019 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1; Guanine…
UniProt
P62871, P02698
Ligands
UNX, CL
Pockets
8 · best druggability 0.82

Structure

x-ray diffraction · 4 distinct chains · 19% helix, 39% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BGuanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1protein3387% helix, 48% strandP62871
CGuanine nucleotide-binding protein G(T) subunit gamma-T1protein5666% helix, 0% strandP02698
DGuanine nucleotide-binding protein G(T) subunit gamma-T1protein5958% helix, 0% strandP02698
E, FNanobody against G protein beta gamma dimerprotein11411% helix, 50% strand—

Ligands and binding sites

  • UNX · Unknown atom or ion · ion · 11 copies · chains A, C, B, D
  • CL · Chloride ion · ion · chains E

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

Pockets

8 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19850.820.8398CL
25460.790.8549empty
35210.780.8549empty
45520.660.7756empty
53090.550.7543empty

Interfaces

10 interfaces between chains.

  • B–D · 2373 Ų buried · 23 hydrogen bonds · protein-protein
  • A–C · 2311 Ų buried · 24 hydrogen bonds · protein-protein
  • B–E · 1097 Ų buried · 22 hydrogen bonds · protein-protein
  • A–F · 1087 Ų buried · 20 hydrogen bonds · protein-protein
  • A–E · 423 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 6B20 · Crystal structure of a complex between G protein beta gamma dimer and an inhibitory… · the same entry in another collection · chain F against F, TM-score 1.00
  • P62871 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(I)/G(S)/G(T)… · a predicted model of the same protein · chain A against A, TM-score 0.99
  • P02698 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(T) subunit… · a predicted model of the same protein · chain C against A, TM-score 0.94

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