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Structure of the lectin from platypodium elegans in complex with a trimannoside

Analyse Structure of the lectin from platypodium elegans in complex with a trimannoside in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3ZVX
Type
protein
Length
483 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lectin
Ligands
MAN, MN, CA, SO4
Pockets
4 · best druggability 0.76

Structure

x-ray diffraction · 2 distinct chains · 4% helix, 46% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALectinprotein2424% helix, 46% strand—
BLectinprotein2414% helix, 46% strand—

Ligands and binding sites

  • MAN · alpha-D-mannopyranose · sugar · 3 copies · chains A
  • MN · Manganese (II) ion · metal · 2 copies · chains A, B
  • CA · Calcium ion · metal · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 2 copies · chains A
  • GOL · Glycerol · additive · 2 copies · chains A, B

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

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1740.760.9918empty
2770.740.9821empty
3830.370.7617empty
4820.360.7616empty

Interfaces

1 interface between chains.

  • A–B · 1143 Ų buried · 35 hydrogen bonds · protein-protein

Compared structures

  • 3ZVX · Structure of the lectin from platypodium elegans in complex with a trimannoside · the same entry in another collection · chain A against A, TM-score 1.00

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