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Structure of a Legionella effector with its substrate

Analyse Structure of a Legionella effector with its substrate in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5YIK
Type
protein
Length
1,184 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.102
Source
Homo sapiens; Legionella pneumophila
Molecule
SdeA; ubiquitin
UniProt
Q6RCR0, P0CG47
Pockets
16 · best druggability 0.74

Structure

x-ray diffraction · resolution 3.102 · 4 distinct chains · 48% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASdeAprotein95955% helix, 9% strandQ6RCR0
Cubiquitinprotein7115% helix, 30% strandP0CG47
Dubiquitinprotein7616% helix, 32% strandP0CG47
Fubiquitinprotein7824% helix, 36% strandP0CG47

Pockets

16 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11520.740.9131empty
27440.710.7866empty
35120.680.7960empty
43640.600.7643empty
51810.560.8023empty

Interfaces

3 interfaces between chains.

  • A–D · 1049 Ų buried · 13 hydrogen bonds · protein-protein
  • A–F · 645 Ų buried · 5 hydrogen bonds · protein-protein
  • A–C · 444 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 5YIK · Structure of a legionella effector with its substrate · the same entry in another collection · chain A against A, TM-score 1.00

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