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Human cytosolic Histidyl-tRNA synthetase (HisRS) with WHEP domain

Analyse Human cytosolic Histidyl-tRNA synthetase (HisRS) with WHEP domain in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6O76
Type
protein
Length
889 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.787
Source
Homo sapiens
Molecule
Histidine--tRNA ligase, cytoplasmic
EC
6.1.1.21
UniProt
P12081
Ligands
CL
Pockets
15 · best druggability 0.82

Structure

x-ray diffraction · resolution 2.787 · 2 distinct chains · 46% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHistidine--tRNA ligase, cytoplasmic (EC 6.1.1.21)protein43844% helix, 21% strandP12081
BHistidine--tRNA ligase, cytoplasmic (EC 6.1.1.21)protein45149% helix, 19% strandP12081

Ligands and binding sites

  • CL · Chloride ion · ion · 2 copies · chains A, B

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

Pockets

15 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16850.820.8643empty
27110.700.7766empty
36270.670.7674empty
46870.670.7663empty
5580.640.9418empty

Interfaces

1 interface between chains.

  • A–B · 4130 Ų buried · 48 hydrogen bonds · protein-protein

Compared structures

  • 6O76 · Human cytosolic histidyl-tRNA synthetase (hisrs) with whep domain · the same entry in another collection · chain A against A, TM-score 1.00
  • P12081 · AlphaFold monomer V2.0 prediction for histidine--tRNA ligase, cytoplasmic (P12081) · a predicted model of the same protein · chain A against A, TM-score 0.98

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