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Crystal structure of exo-beta-1,3-galactanase from phanerochaete chrysosporium PC1,3GAL43A with galactose

Analyse Crystal structure of exo-beta-1,3-galactanase from phanerochaete chrysosporium… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7BYT
Type
protein
Length
427 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Galactan 1,3-beta-galactosidase
EC
3.2.1.145
UniProt
Q50KB2
Ligands
NAG, GLA, GAL, CA
Pockets
4 · best druggability 0.57

Structure

x-ray diffraction · 1 distinct chain · 4% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGalactan 1,3-beta-galactosidase (EC 3.2.1.145)protein4274% helix, 52% strandQ50KB2

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 4 copies · chains A
  • GLA · alpha-D-galactopyranose · sugar · chains A
  • GAL · beta-D-galactopyranose · sugar · chains A
  • CA · Calcium ion · metal · chains A
  • GOL · Glycerol · additive · 4 copies · chains A
  • ACY · Acetic acid · additive · 2 copies · chains A
  • ACT · Acetate ion · additive · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12430.570.7825GOL
2880.470.8118GOL
3950.450.8015GLA, GOL
4630.390.7918empty

Modifications

Observed in the structure: 3 glycan, 1 disulfide (N-glycosylation, disulfide).

Compared structures

  • 7BYT · Crystal structure of exo-beta-1,3-galactanase from Phanerochaete chrysosporium… · the same entry in another collection · chain A against A, TM-score 1.00

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