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MolNFT v1 · #81308 · protein

Crystal structure of the G202A mutant of human G-alpha-I1

3UMS · Guanine nucleotide-binding protein G(I) subunit alpha-1: “Crystal structure of the G202A mutant of human G-alpha-I1”. X-ray diffraction, 3 ligands (GDP, SO4, CL), 3 pockets (best druggability 0.70). MolNFT v1 #81308 on GenesisL1: 3D…

PDB
3UMS
Type
protein
Length
337 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Guanine nucleotide-binding protein G(I) subunit alpha-1
UniProt
P63096
Ligands
GDP, SO4, CL
Pockets
3 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 53% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGuanine nucleotide-binding protein G(I) subunit alpha-1protein33753% helix, 14% strandP63096

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · chains A
  • SO4 · Sulfate ion · ion · chains A
  • CL · Chloride ion · ion · chains A

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

Pockets

3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12290.700.8732GDP
22440.560.7832empty
3540.290.7511empty

Compared structures

  • 3UMS · Crystal structure of the G202A mutant of human G-alpha-i1 · the same entry in another collection · chain A against A, TM-score 1.00
  • P63096 · 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 0.91

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