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E. COLI elongation factor ef-tu complexed with the antibiotic kirromycin, a GTP analog, and phe-tRNA

Analyse E. COLI elongation factor ef-tu complexed with the antibiotic kirromycin, a GTP… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1OB2
Type
protein + RNA
Length
469 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Elongation factor tu; Transfer-RNA, phe
EC
3.6.1.48
UniProt
P0CE48
Ligands
PHA, KIR, GNP, GLC, FRU, MG
Pockets
8 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 25% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AElongation factor tu (EC 3.6.1.48)protein39325% helix, 30% strandP0CE48
BTransfer-RNA, pherna76——

Ligands and binding sites

  • PHA · Phenylalaninal · ligand · chains A, B
  • KIR · Kirromycin · ligand · chains A
  • GNP · Phosphoaminophosphonic acid-guanylate ester · ligand · chains A
  • GLC · alpha-D-glucopyranose · sugar · chains A
  • FRU · beta-D-fructofuranose · sugar · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

8 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19070.780.8186PHA
24240.650.7855KIR
32780.560.7821empty
42980.510.7522empty
5670.440.8313empty

Interfaces

1 interface between chains.

  • A–B · 1278 Ų buried · 30 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 13 modified, 1 covalent (nucleotide modification, covalent ligand).

Compared structures

  • 1OB2 · E. coli elongation factor EF-Tu complexed with the antibiotic kirromycin, a GTP analog… · the same entry in another collection · chain A against A, TM-score 1.00
  • P0CE48 · AlphaFold monomer V2.0 prediction for elongation factor tu 2 (P0CE48) · a predicted model of the same protein · chain A against A, TM-score 0.93

Analyse

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