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Structure of P. aeruginosa acetyltransferase PA4866

Analyse Structure of P. aeruginosa acetyltransferase PA4866 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2J8M
Type
protein
Length
341 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Acetyltransferase PA4866 from P. aeruginosa
UniProt
Q9HUU7
Ligands
AZI, SO4
Pockets
1 · best druggability 0.80

Structure

x-ray diffraction · 2 distinct chains · 35% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAcetyltransferase PA4866 from P. aeruginosaprotein17134% helix, 33% strandQ9HUU7
BAcetyltransferase PA4866 from P. aeruginosaprotein17035% helix, 33% strandQ9HUU7

Ligands and binding sites

  • AZI · Azide ion · ion · 8 copies · chains A, B
  • SO4 · Sulfate ion · ion · chains B
  • GOL · Glycerol · additive · 6 copies · chains A, B

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111070.800.82108AZI, GOL, SO4

Interfaces

1 interface between chains.

  • A–B · 1718 Ų buried · 33 hydrogen bonds · protein-protein

Compared structures

  • 2J8M · Structure of P. aeruginosa acetyltransferase PA4866 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9HUU7 · AlphaFold monomer V2.0 prediction for L-methionine SULFOXIMINE/L-methionine sulfone… · a predicted model of the same protein · chain B against A, TM-score 1.00

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