GL1X · GenesisL1 explorer

MolNFT v1 · #114706 · protein

EIF4E complex

5BXV · Eukaryotic translation initiation factor 4E: “EIF4E complex”. X-ray diffraction, 1 ligand (MGP), 5 pockets (best druggability 0.72). MolNFT v1 #114706 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5BXV
Type
protein
Length
423 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Eukaryotic translation initiation factor 4E; Eukaryotic translation initiation factor…
UniProt
P63073, Q13541
Ligands
MGP
Pockets
5 · best druggability 0.72

Structure

x-ray diffraction · 4 distinct chains · 34% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEukaryotic translation initiation factor 4Eprotein17434% helix, 29% strandP63073
BEukaryotic translation initiation factor 4E-binding protein 1protein3531% helix, 3% strandQ13541
CEukaryotic translation initiation factor 4Eprotein18132% helix, 29% strandP63073
DEukaryotic translation initiation factor 4E-binding protein 1protein3339% helix, 3% strandQ13541

Ligands and binding sites

  • MGP · 7-methyl-guanosine-5'-triphosphate · ligand · 2 copies · chains A, C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16580.720.7966empty
21260.600.8528empty
31130.450.7816MGP
4950.440.7920MGP
5640.250.7120empty

Interfaces

5 interfaces between chains.

  • C–D · 1383 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 1353 Ų buried · 18 hydrogen bonds · protein-protein
  • A–C · 342 Ų buried · 6 hydrogen bonds · protein-protein
  • B–C · 277 Ų buried · 0 hydrogen bonds · protein-protein
  • A–D · 152 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 5BXV · eIF4E complex · the same entry in another collection · chain D against D, TM-score 1.00
  • P63073 · AlphaFold monomer V2.0 prediction for eukaryotic translation initiation factor 4E (P63073) · a predicted model of the same protein · chain C against A, TM-score 0.99
  • Q13541 · AlphaFold monomer V2.0 prediction for eukaryotic translation initiation factor 4E-binding… · a predicted model of the same protein · chain D against A, TM-score 0.85

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