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Effector domain of pseudomonas aeruginosa VGRG2B

Analyse Effector domain of pseudomonas aeruginosa VGRG2B in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6H56
Type
protein
Length
360 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Effector domain of pseudomonas aeruginosa VGRG2B
UniProt
Q9I6M7
Ligands
ZN
Pockets
4 · best druggability 0.66

Structure

x-ray diffraction · 2 distinct chains · 54% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEffector domain of pseudomonas aeruginosa VGRG2Bprotein18155% helix, 5% strandQ9I6M7
BEffector domain of pseudomonas aeruginosa VGRG2Bprotein17954% helix, 5% strandQ9I6M7

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13560.660.8042ZN
24020.650.7842ZN
3910.370.7517empty
4880.360.7416empty

Interfaces

1 interface between chains.

  • A–B · 561 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 6H56 · Effector domain of Pseudomonas aeruginosa VgrG2b · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9I6M7 · AlphaFold monomer V2.0 prediction for type VI secretion system spike protein VGRG2B… · a predicted model of the same protein · chain B against A, TM-score 0.88

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