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The crystal structure of the periplasmic protease PqqL from Escherichia coli

Analyse The crystal structure of the periplasmic protease PqqL from Escherichia coli in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6OFS
Type
protein
Length
905 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.6
Source
Escherichia coli (strain K12)
Molecule
Probable zinc protease PqqL
EC
3.4.24.-
UniProt
P31828
Ligands
ZN, CL
Pockets
13 · best druggability 0.68

Structure

x-ray diffraction · resolution 2.6 · 1 distinct chain · 46% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProbable zinc protease PqqL (EC 3.4.24.-)protein90546% helix, 20% strandP31828

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • CL · Chloride ion · ion · 2 copies · chains A

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

Pockets

13 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16080.680.7746CL
23800.670.8042empty
33880.560.7443ZN
4660.510.8515empty
52360.500.7530empty

Compared structures

  • 6OFS · The crystal structure of the periplasmic protease pqql from escherichia COLI · the same entry in another collection · chain A against A, TM-score 1.00
  • P31828 · AlphaFold monomer V2.0 prediction for probable zinc protease pqql (P31828) · a predicted model of the same protein · chain A against A, TM-score 0.52

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