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Native crystal structure of Trichoderma reesei beta-galactosidase

Analyse Native crystal structure of Trichoderma reesei beta-galactosidase in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3OG2
Type
protein
Length
986 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.2
Source
Trichoderma reesei
Molecule
Beta-galactosidase
EC
3.2.1.23
UniProt
Q70SY0
Ligands
MAN, NAG, BMA, GLC
Pockets
7 · best druggability 0.56

Structure

x-ray diffraction · resolution 1.2 · 1 distinct chain · 15% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABeta-galactosidase (EC 3.2.1.23)protein98615% helix, 32% strandQ70SY0

Ligands and binding sites

  • MAN · alpha-D-mannopyranose · sugar · 11 copies · chains A
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 8 copies · chains A
  • BMA · beta-D-mannopyranose · sugar · 2 copies · chains A
  • GLC · alpha-D-glucopyranose · sugar · 2 copies · chains A
  • GOL · Glycerol · additive · 2 copies · chains A

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

Pockets

7 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11570.560.8220empty
21240.560.8326empty
3890.500.8318empty
4740.390.7819GOL
5610.350.7820empty

Modifications

Observed in the structure: 5 glycan, 1 disulfide (N-glycosylation, disulfide).

Compared structures

  • 3OG2 · Native crystal structure of trichoderma reesei beta-galactosidase · the same entry in another collection · chain A against A, TM-score 1.00

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