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Crystal structure of nagz H174A mutant from pseudomonas aeruginosa

Analyse Crystal structure of nagz H174A mutant from pseudomonas aeruginosa in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5G5U
Type
protein
Length
666 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-hexosaminidase
EC
3.2.1.52
UniProt
Q9HZK0
Pockets
5 · best druggability 0.79

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BBeta-hexosaminidase (EC 3.2.1.52)protein33342% helix, 13% strandQ9HZK0

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111400.790.80111empty
21580.460.7620empty
3850.430.7918empty
4910.360.7517empty
5830.360.7615empty

Interfaces

1 interface between chains.

  • A–B · 390 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 5G5U · Crystal structure of NagZ H174A mutant from Pseudomonas aeruginosa · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9HZK0 · AlphaFold monomer V2.0 prediction for beta-hexosaminidase (Q9HZK0) · a predicted model of the same protein · chain A against A, TM-score 0.93

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