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MolNFT v1 · #66673 · protein

Crystal structure of schistosome EIF4E complexed with M7GPPPG and 4E-bp

3HXI · Eukaryotic translation initiation 4E: “Crystal structure of schistosome EIF4E complexed with M7GPPPG and 4E-bp”. X-ray diffraction, 1 ligand (GTG), 1 pocket (best druggability 0.54). MolNFT v1 #66673 on GenesisL1: 3D structure…

PDB
3HXI
Type
protein
Length
196 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Eukaryotic translation initiation 4E; Eukaryotic translation initiation factor 4E…
UniProt
Q13541
Ligands
GTG
Pockets
1 · best druggability 0.54

Structure

x-ray diffraction · 2 distinct chains · 33% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEukaryotic translation initiation 4Eprotein18231% helix, 28% strand—
CEukaryotic translation initiation factor 4E- binding protein 1protein1450% helix, 0% strandQ13541

Ligands and binding sites

  • GTG · 7-methyl-guanosine-5'-triphosphate-5'-guanosine · ligand · chains A

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12400.540.7726GTG

Interfaces

1 interface between chains.

  • A–C · 764 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 3HXI · Crystal structure of Schistosome eIF4E complexed with m7GpppG and 4E-BP · the same entry in another collection · chain A against A, TM-score 1.00
  • Q13541 · AlphaFold monomer V2.0 prediction for eukaryotic translation initiation factor 4E-binding… · a predicted model of the same protein · chain C against A, TM-score 0.65

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