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MolNFT v1 · #84432 · protein

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

3ZKL · Putative sugar transporter solute-binding protein: “Structure of the xylo-oligosaccharide specific solute binding protein from bifidobacterium animalis subsp.…”. X-ray diffraction, 1 ligand (XYP), 3 pockets (best druggability 0.80).…

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

Structure

x-ray diffraction · 1 distinct chain · 48% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative sugar transporter solute-binding proteinprotein39648% helix, 16% strandC6A6Z1

Ligands and binding sites

  • XYP · beta-D-xylopyranose · sugar · 3 copies · chains A
  • 1PE · Pentaethylene glycol · additive · 2 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
14680.800.8750XYP
21790.440.7427empty
3550.390.8117empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 3ZKL · 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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