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Stapled-peptides tailored against initiation of translation

Analyse Stapled-peptides tailored against initiation of translation in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5ZK9
Type
protein
Length
196 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Eukaryotic translation initiation factor 4E; ACE-arg-ile-ile-tyr-ser-arg-MK8-gln-leu-leu-M…
UniProt
P06730
Ligands
ACE, MGP, NH2
Pockets
1 · best druggability 0.47

Structure

x-ray diffraction · 2 distinct chains · 34% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEukaryotic translation initiation factor 4Eprotein18333% helix, 28% strandP06730
BACE-arg-ile-ile-tyr-ser-arg-MK8-gln-leu-leu-MK8-leu-lys- NH2protein1346% helix, 0% strand—

Ligands and binding sites

  • ACE · Acetyl group · ligand · chains A, B
  • MGP · 7-methyl-guanosine-5'-triphosphate · ligand · chains A
  • NH2 · Amino group · ion · chains B
  • PEG · Di(hydroxyethyl)ether · additive · 2 copies · chains A, B
  • GOL · Glycerol · additive · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11120.470.7920MGP

Interfaces

1 interface between chains.

  • A–B · 675 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified, 1 covalent (nonstandard, covalent ligand).

Compared structures

  • 5ZK9 · Stapled-peptides tailored against initiation of translation · the same entry in another collection · chain A against A, TM-score 1.00
  • P06730 · AlphaFold monomer V2.0 prediction for eukaryotic translation initiation factor 4E (P06730) · a predicted model of the same protein · chain A against A, TM-score 0.98

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