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Structure of sgbp BO2743 from bacteroides ovatus

Analyse Structure of sgbp BO2743 from bacteroides ovatus in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7O8C
Type
protein
Length
1,161 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Surface glycan-binding protein BO2743
UniProt
A7LY27
Ligands
SO4, AZI
Pockets
16 · best druggability 0.86

Structure

x-ray diffraction · 2 distinct chains · 56% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASurface glycan-binding protein BO2743protein58256% helix, 5% strandA7LY27
BSurface glycan-binding protein BO2743protein57956% helix, 5% strandA7LY27

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 11 copies · chains A, B
  • AZI · Azide ion · ion · 3 copies · chains A, B
  • GOL · Glycerol · additive · 9 copies · chains A, B
  • BME · Beta-mercaptoethanol · additive · 5 copies · chains A, B
  • HED · 2-hydroxyethyl disulfide · additive · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110460.860.8777HED, BME
23160.620.7942empty
32290.570.7932AZI
43120.560.7647GOL
51920.480.7628SO4

Interfaces

1 interface between chains.

  • A–B · 2094 Ų buried · 21 hydrogen bonds · protein-protein

Compared structures

  • 7O8C · Structure of SGBP BO2743 from Bacteroides ovatus · the same entry in another collection · chain A against A, TM-score 1.00

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