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Catalytic core domain of adenosine triphosphate phosphoribosyltransferase from campylobacter jejuni

Analyse Catalytic core domain of adenosine triphosphate phosphoribosyltransferase from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5UB9
Type
protein
Length
435 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ATP phosphoribosyltransferase
EC
2.4.2.17
UniProt
Q5HSJ4
Ligands
ZN, CL
Pockets
1 · best druggability 0.80

Structure

x-ray diffraction · 2 distinct chains · 33% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AATP phosphoribosyltransferase (EC 2.4.2.17)protein22033% helix, 30% strandQ5HSJ4
BATP phosphoribosyltransferase (EC 2.4.2.17)protein21533% helix, 30% strandQ5HSJ4

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, B
  • CL · Chloride ion · ion · chains A
  • ACT · Acetate ion · additive · 5 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
19640.800.82101ACT

Interfaces

1 interface between chains.

  • A–B · 1334 Ų buried · 20 hydrogen bonds · protein-protein

Compared structures

  • 5UB9 · Catalytic core domain of Adenosine triphosphate phosphoribosyltransferase from… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q5HSJ4 · AlphaFold monomer V2.0 prediction for ATP phosphoribosyltransferase (Q5HSJ4) · a predicted model of the same protein · chain B against A, TM-score 0.98

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