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Crystal structure of a putative glycosyl hydrolase (BDI_2473) from parabacteroides distasonis atcc 8503 at 1.85 a resolution

Analyse Crystal structure of a putative glycosyl hydrolase (BDI_2473) from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3S5Q
Type
protein
Length
213 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative glycosylhydrolase
UniProt
A6LES9
Ligands
IOD
Pockets
2 · best druggability 0.47

Structure

x-ray diffraction · 1 distinct chain · 10% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative glycosylhydrolaseprotein21310% helix, 38% strandA6LES9

Ligands and binding sites

  • IOD · Iodide ion · ion · 3 copies · chains A
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A

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
11020.470.8019empty
2530.250.7315empty

Modifications

Observed in the structure: 2 modified (engineered).

Compared structures

  • 3S5Q · Crystal structure of a putative glycosyl hydrolase (BDI_2473) from Parabacteroides… · the same entry in another collection · chain A against A, TM-score 1.00

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