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MolNFT v1 · #141586 · protein

Crystal structure of alpha-glucosidase in complex with maltotriose

5ZCD: “Crystal structure of alpha-glucosidase in complex with maltotriose”. X-ray diffraction, 2 ligands (GLC, CA), 4 pockets (best druggability 0.69). MolNFT v1 #141586 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5ZCD
Type
protein
Length
545 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Alpha-glucosidase
Ligands
GLC, CA
Pockets
4 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAlpha-glucosidaseprotein54535% helix, 19% strand—

Ligands and binding sites

  • GLC · alpha-D-glucopyranose · sugar · 3 copies · chains A
  • CA · Calcium ion · metal · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14950.690.7947GLC
2990.400.7719empty
3840.350.7518empty
4500.290.7517empty

Compared structures

  • 5ZCD · Crystal structure of Alpha-glucosidase in complex with maltotriose · the same entry in another collection · chain A against A, TM-score 1.00

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