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Fragment of NITRATE/NITRITE sensor histidine kinase narq (wt) in symmetric holo state

Analyse Fragment of NITRATE/NITRITE sensor histidine kinase narq (wt) in symmetric holo… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5IJI
Type
protein
Length
227 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
NITRATE/NITRITE sensor histidine kinase narq
EC
2.7.13.3
UniProt
P27896
Ligands
LFA, NO3
Pockets
2 · best druggability 0.48

Structure

x-ray diffraction · 1 distinct chain · 81% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANITRATE/NITRITE sensor histidine kinase narq (EC 2.7.13.3)protein22781% helix, 0% strandP27896

Ligands and binding sites

  • LFA · Eicosane · ligand · 5 copies · chains A
  • NO3 · Nitrate ion · ion · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1770.480.8318empty
2610.350.7719empty

Compared structures

  • 5IJI · Fragment of nitrate/nitrite sensor histidine kinase NarQ (WT) in symmetric holo state · the same entry in another collection · chain A against A, TM-score 1.00
  • P27896 · AlphaFold monomer V2.0 prediction for NITRATE/NITRITE sensor protein narq (P27896) · a predicted model of the same protein · chain A against A, TM-score 0.88

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