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The crystal structure of ejc in its transition state

Analyse The crystal structure of ejc in its transition state in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3EX7
Type
protein + RNA
Length
1,386 residues
Chains
10
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein mago nashi homolog; RNA-binding protein 8A; Eukaryotic initiation factor 4A-III…
EC
3.6.1.-
UniProt
P61326, Q9Y5S9, P38919, O15234
Ligands
ADP, AF3, MG
Pockets
17 · best druggability 0.78

Structure

x-ray diffraction · 8 distinct chains · 33% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein mago nashi homologprotein14435% helix, 35% strandP61326
BRNA-binding protein 8Aprotein9421% helix, 29% strandQ9Y5S9
C, HEukaryotic initiation factor 4A-III (EC 3.6.1.-)protein39240% helix, 17% strandP38919
DProtein CASC3protein5714% helix, 0% strandO15234
EProtein mago nashi homologprotein14238% helix, 33% strandP61326
GRNA-binding protein 8Aprotein9122% helix, 31% strandQ9Y5S9
IProtein CASC3protein6223% helix, 0% strandO15234
F, JRNA (5'-R(*UP*UP*UP*UP*UP*U)-3')rna6——

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · 2 copies · chains C, H
  • AF3 · Aluminum fluoride · ligand · 2 copies · chains C, H
  • MG · Magnesium ion · metal · 2 copies · chains C, H

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

Pockets

17 pockets found on a 1 Å grid, 11 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18600.780.8177empty
27890.780.8271empty
39230.750.7879empty
42830.740.8742empty
5720.740.9820empty

Interfaces

16 interfaces between chains.

  • H–I · 2315 Ų buried · 42 hydrogen bonds · protein-protein
  • C–D · 2285 Ų buried · 41 hydrogen bonds · protein-protein
  • A–C · 1678 Ų buried · 40 hydrogen bonds · protein-protein
  • E–H · 1643 Ų buried · 39 hydrogen bonds · protein-protein
  • A–B · 1344 Ų buried · 20 hydrogen bonds · protein-protein

Compared structures

  • 3EX7 · The crystal structure of EJC in its transition state · the same entry in another collection · chain J against J, TM-score 1.00
  • Q9Y5S9 · AlphaFold monomer V2.0 prediction for RNA-binding protein 8A (Q9Y5S9) · a predicted model of the same protein · chain B against A, TM-score 1.00
  • P38919 · AlphaFold monomer V2.0 prediction for eukaryotic initiation factor 4A-III (P38919) · a predicted model of the same protein · chain C against A, TM-score 0.99

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