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MolNFT v1 · #120578 · protein

Structure of glutamyl-tRNA synthetase (XOO1504) from xanthomonas oryzae pv. oryzae

5H4V · Glutamate--tRNA ligase: “Structure of glutamyl-tRNA synthetase (XOO1504) from xanthomonas oryzae pv. oryzae”. X-ray diffraction, 20 pockets (best druggability 0.81). MolNFT v1 #120578 on GenesisL1: 3D structure, binding sites and…

PDB
5H4V
Type
protein
Length
2,775 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glutamate--tRNA ligase
EC
6.1.1.17
UniProt
Q5H2R3
Pockets
20 · best druggability 0.81

Structure

x-ray diffraction · 3 distinct chains · 47% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D, E, FGlutamate--tRNA ligase (EC 6.1.1.17)protein46546% helix, 12% strandQ5H2R3
BGlutamate--tRNA ligase (EC 6.1.1.17)protein46049% helix, 12% strandQ5H2R3
CGlutamate--tRNA ligase (EC 6.1.1.17)protein45547% helix, 11% strandQ5H2R3

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18570.810.8495empty
210060.810.82114empty
38070.800.8392empty
49380.790.81111empty
56340.770.8379empty

Interfaces

12 interfaces between chains.

  • C–F · 945 Ų buried · 7 hydrogen bonds · protein-protein
  • A–F · 893 Ų buried · 7 hydrogen bonds · protein-protein
  • D–E · 887 Ų buried · 14 hydrogen bonds · protein-protein
  • B–D · 880 Ų buried · 7 hydrogen bonds · protein-protein
  • B–E · 879 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 5H4V · Structure of glutamyl-tRNA synthetase (Xoo1504) from Xanthomonas oryzae pv. oryzae · the same entry in another collection · chain F against F, TM-score 1.00
  • Q5H2R3 · AlphaFold monomer V2.0 prediction for glutamate--tRNA ligase (Q5H2R3) · a predicted model of the same protein · chain B against A, TM-score 0.98

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