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Concanavalin from canavalia brasiliensis

Analyse Concanavalin from canavalia brasiliensis in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1AZD
Type
protein
Length
948 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Conbr
UniProt
P55915
Ligands
CA, MN
Pockets
8 · best druggability 0.87

Structure

x-ray diffraction · 1 distinct chain · 4% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DConbrprotein2374% helix, 44% strandP55915

Ligands and binding sites

  • CA · Calcium ion · metal · 4 copies · chains A, B, C, D
  • MN · Manganese (II) ion · metal · 4 copies · chains A, B, C, D

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

Pockets

8 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110740.870.8892empty
2500.680.9716empty
31750.610.8436empty
42040.610.8236empty
51730.600.8336empty

Interfaces

6 interfaces between chains.

  • A–B · 1216 Ų buried · 15 hydrogen bonds · protein-protein
  • C–D · 1200 Ų buried · 16 hydrogen bonds · protein-protein
  • B–D · 1057 Ų buried · 16 hydrogen bonds · protein-protein
  • A–C · 1042 Ų buried · 13 hydrogen bonds · protein-protein
  • A–D · 61 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 1AZD · Concanavalin from canavalia brasiliensis · the same entry in another collection · chain A against A, TM-score 1.00
  • P55915 · AlphaFold monomer V2.0 prediction for concanavalin-br (P55915) · a predicted model of the same protein · chain A against A, TM-score 0.99

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