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Structure of a mutant methionyl-tRNA synthetase with modified specificity complexed with azidonorleucine

Analyse Structure of a mutant methionyl-tRNA synthetase with modified specificity… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3H9B
Type
protein
Length
544 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Methionyl-tRNA synthetase
EC
6.1.1.10
UniProt
P00959
Ligands
NOT, ZN
Pockets
2 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 51% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMethionyl-tRNA synthetase (EC 6.1.1.10)protein54451% helix, 17% strandP00959

Ligands and binding sites

  • NOT · 6-azido-L-norleucine · ligand · chains A
  • ZN · Zinc ion · metal · chains A
  • CIT · Citric acid · additive · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13280.640.7935NOT
21890.520.7734CIT

Compared structures

  • 3H9B · Structure of a mutant methionyl-tRNA synthetase with modified specificity complexed with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P00959 · AlphaFold monomer V2.0 prediction for methionine--tRNA ligase (P00959) · a predicted model of the same protein · chain A against A, TM-score 1.00

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