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Structure of the xylo-oligosaccharide specific solute binding protein from bifidobacterium animalis subsp. lactis bl-04 in complex with arabinoxylobiose

Analyse Structure of the xylo-oligosaccharide specific solute binding protein from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4C1U
Type
protein
Length
396 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Sugar transporter solute-binding protein
UniProt
C6A6Z1
Ligands
XYP, AHR
Pockets
3 · best druggability 0.80

Structure

x-ray diffraction · 1 distinct chain · 49% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASugar transporter solute-binding proteinprotein39649% helix, 16% strandC6A6Z1

Ligands and binding sites

  • XYP · beta-D-xylopyranose · sugar · 2 copies · chains A
  • AHR · alpha-L-arabinofuranose · sugar · chains A
  • 1PE · Pentaethylene glycol · additive · 4 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15120.800.8756XYP, AHR
2810.350.7519empty
3810.330.7415empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 4C1U · Structure of the xylo-oligosaccharide specific solute binding protein from… · the same entry in another collection · chain A against A, TM-score 1.00

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