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Edta-treated (2 weeks) P. angolensis lectin

Analyse Edta-treated (2 weeks) P. angolensis lectin in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2GNB
Type
protein
Length
466 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lectin
UniProt
Q8GSD2
Ligands
MAN
Pockets
3 · best druggability 0.40

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALectinprotein2374% helix, 49% strandQ8GSD2
BLectinprotein2295% helix, 50% strandQ8GSD2

Ligands and binding sites

  • MAN · alpha-D-mannopyranose · sugar · chains B

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

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1810.400.7817empty
2600.340.7716empty
3630.330.7616empty

Interfaces

1 interface between chains.

  • A–B · 941 Ų buried · 18 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (cyclization).

Compared structures

  • 2GNB · EDTA-treated (2 weeks) P. angolensis lectin · the same entry in another collection · chain A against A, TM-score 1.00

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