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Crystal structure of the 4 alanine insertion variant of the gi ALPHA1 subunit bound to gtpgammas

Analyse Crystal structure of the 4 alanine insertion variant of the gi ALPHA1 subunit… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5KDL
Type
protein
Length
618 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Guanine nucleotide-binding protein G(I) subunit alpha-1
UniProt
P10824
Ligands
GSP, MG
Pockets
8 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 52% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGuanine nucleotide-binding protein G(I) subunit alpha-1protein30751% helix, 14% strandP10824
BGuanine nucleotide-binding protein G(I) subunit alpha-1protein31154% helix, 13% strandP10824

Ligands and binding sites

  • GSP · 5'-guanosine-diphosphate-monothiophosphate · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 2 copies · chains A, B

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
12100.780.9336MG, GSP
22940.730.8646MG, GSP
36720.720.7979empty
42140.610.8226empty
5570.530.8718empty

Interfaces

1 interface between chains.

  • A–B · 234 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 5KDL · Crystal structure of the 4 alanine insertion variant of the Gi alpha1 subunit bound to… · the same entry in another collection · chain A against A, TM-score 1.00
  • P10824 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(I) subunit… · a predicted model of the same protein · chain A against A, TM-score 0.99

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