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The ABC transporter associated binding protein from B. animalis subsp. lactis Bl-04 in complex with beta-1,6-galactobiose

Analyse The ABC transporter associated binding protein from B. animalis subsp. lactis… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6H0H
Type
protein
Length
820 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.39
Source
Bifidobacterium animalis subsp. lactis Bl-04
Molecule
Probable solute binding protein of ABC transporter system for sugars
UniProt
B8DWA9
Ligands
GAL, GLA
Pockets
9 · best druggability 0.79

Structure

x-ray diffraction · resolution 1.39 · 1 distinct chain · 45% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BProbable solute binding protein of ABC transporter system for sugarsprotein41045% helix, 17% strandB8DWA9

Ligands and binding sites

  • GAL · beta-D-galactopyranose · sugar · 6 copies · chains A, B
  • GLA · alpha-D-galactopyranose · sugar · 2 copies · chains A, B
  • PG4 · Tetraethylene glycol · additive · 3 copies · chains A, B
  • PEG · Di(hydroxyethyl)ether · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110310.790.81116GAL, GLA
23000.750.8846GAL, GLA
33100.590.7843empty
42530.510.7532empty
51530.470.7738PG4

Interfaces

1 interface between chains.

  • A–B · 858 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 6H0H · The ABC transporter associated binding protein from B. animalis subsp. lactis bl-04 in… · the same entry in another collection · chain A against A, TM-score 1.00

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