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MolNFT v1 · #23249 · protein

Intact elongation factor tu in complex with GDP

1TUI: “Intact elongation factor tu in complex with GDP”. X-ray diffraction, 2 ligands (GDP, MG), 10 pockets (best druggability 0.55). MolNFT v1 #23249 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1TUI
Type
protein
Length
1,191 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Elongation factor tu
UniProt
Q01698
Ligands
GDP, MG
Pockets
10 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 23% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CElongation factor tuprotein39723% helix, 35% strandQ01698

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · 3 copies · chains A, B, C
  • MG · Magnesium ion · metal · 3 copies · chains A, B, C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12750.550.7726empty
22030.510.7722empty
31550.500.7838empty
42400.480.7438empty
51320.460.7823empty

Interfaces

2 interfaces between chains.

  • B–C · 424 Ų buried · 8 hydrogen bonds · protein-protein
  • A–B · 341 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 1TUI · Intact elongation factor tu in complex with GDP · the same entry in another collection · chain A against A, TM-score 1.00
  • Q01698 · AlphaFold monomer V2.0 prediction for elongation factor tu (Q01698) · a predicted model of the same protein · chain C against A, TM-score 0.61

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