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Structure of the hexagonal form of the boletus edulis lectin in complex with N-acetyl glucosamine and N-acetyl galactosamine

Analyse Structure of the hexagonal form of the boletus edulis lectin in complex with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3QDW
Type
protein
Length
284 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Boletus edulis lectin
Ligands
ACE, A2G, NDG

Structure

x-ray diffraction · 1 distinct chain · 14% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BBoletus edulis lectinprotein14214% helix, 52% strand—

Ligands and binding sites

  • ACE · Acetyl group · ligand · 2 copies · chains A, B
  • A2G · 2-acetamido-2-deoxy-alpha-D-galactopyranose · sugar · 2 copies · chains A, B
  • NDG · 2-acetamido-2-deoxy-alpha-D-glucopyranose · sugar · 2 copies · chains A, B

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

Interfaces

1 interface between chains.

  • A–B · 136 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 covalent (covalent ligand).

Compared structures

  • 3QDW · Structure of the hexagonal form of the Boletus edulis lectin in complex with N-acetyl… · the same entry in another collection · chain A against A, TM-score 1.00

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