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Carbohydrate binding module (CBM6cm-2) from Cellvibrio mixtus lichenase 5A in complex with xylotetraose

Analyse Carbohydrate binding module (CBM6cm-2) from Cellvibrio mixtus lichenase 5A in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1UYZ
Type
protein
Length
262 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.6
Source
CELLVIBRIO MIXTUS
Molecule
Cellulase B
UniProt
O07653
Ligands
XYP, CA, NA
Pockets
2 · best druggability 0.41

Structure

x-ray diffraction · resolution 1.6 · 1 distinct chain · 0% helix, 62% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BCellulase Bprotein1310% helix, 62% strandO07653

Ligands and binding sites

  • XYP · beta-D-xylopyranose · sugar · 4 copies · chains A, B
  • CA · Calcium ion · metal · 4 copies · chains A, B
  • NA · Sodium ion · metal · 3 copies · chains A, B
  • GOL · Glycerol · additive · 3 copies · chains A, B

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

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11490.410.7424GOL
2760.370.7720GOL

Interfaces

1 interface between chains.

  • A–B · 484 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 1UYZ · Carbohydrate binding module (CBM6CM-2) from cellvibrio mixtus lichenase 5A in complex… · the same entry in another collection · chain A against A, TM-score 1.00

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