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MolNFT v1 · #105704 · protein

Structure of AIF2-gamma H97A variant from sulfolobus solfataricus bound to gdpnp

4RD2 · Translation initiation factor 2 subunit gamma: “Structure of AIF2-gamma H97A variant from sulfolobus solfataricus bound to gdpnp”. X-ray diffraction, 2 ligands (GNP, MG), 5 pockets (best druggability 0.56). MolNFT v1 #105704 on…

PDB
4RD2
Type
protein
Length
414 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Translation initiation factor 2 subunit gamma
UniProt
Q980A5
Ligands
GNP, MG
Pockets
5 · best druggability 0.56

Structure

x-ray diffraction · 1 distinct chain · 19% helix, 39% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATranslation initiation factor 2 subunit gammaprotein41419% helix, 39% strandQ980A5

Ligands and binding sites

  • GNP · Phosphoaminophosphonic acid-guanylate ester · ligand · 2 copies · chains A
  • MG · Magnesium ion · metal · chains A
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11970.560.8038empty
22580.550.7735empty
32710.540.7646GNP
41050.450.7925GNP, MG
5570.280.7413empty

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 4RD2 · Structure of aIF2-gamma H97A variant from Sulfolobus solfataricus bound to GDPNP · the same entry in another collection · chain A against A, TM-score 1.00
  • Q980A5 · AlphaFold monomer V2.0 prediction for translation initiation factor 2 subunit gamma… · a predicted model of the same protein · chain A against A, TM-score 0.98

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