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Crystal structure of peanut lectin lactose-azobenzene-4,4'- dicarboxylic acid-lactose complex

Analyse Crystal structure of peanut lectin lactose-azobenzene-4,4'- dicarboxylic… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2DH1
Type
protein
Length
928 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Galactose-binding lectin
UniProt
P02872
Pockets
6 · best druggability 0.48

Structure

x-ray diffraction · 1 distinct chain · 0% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DGalactose-binding lectinprotein2320% helix, 0% strandP02872

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12140.480.7352empty
21860.470.7340empty
31440.420.7339empty
41200.400.7331empty
5710.310.7222empty

Interfaces

3 interfaces between chains.

  • A–D · 59 Ų buried · 0 hydrogen bonds · protein-protein
  • B–C · 41 Ų buried · 0 hydrogen bonds · protein-protein
  • A–B · 15 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 2DH1 · Crystal structure of peanut lectin lactose-azobenzene-4,4'-dicarboxylic acid-lactose… · the same entry in another collection · chain A against A, TM-score 1.00
  • P02872 · AlphaFold monomer V2.0 prediction for galactose-binding lectin (P02872) · a predicted model of the same protein · chain A against A, TM-score 0.99

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