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Comparison of the binding of glucose and glucose-1-phosphate derivatives to T-state glycogen phosphorylase B

Analyse Comparison of the binding of glucose and glucose-1-phosphate derivatives to… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3GPB
Type
protein
Length
833 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycogen phosphorylase B
EC
2.4.1.1
UniProt
P00489
Ligands
G1P, PLP
Pockets
14 · best druggability 0.86

Structure

x-ray diffraction · 1 distinct chain · 51% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlycogen phosphorylase B (EC 2.4.1.1)protein83351% helix, 14% strandP00489

Ligands and binding sites

  • G1P · 1-O-phosphono-alpha-D-glucopyranose · ligand · 2 copies · chains A
  • PLP · Pyridoxal-5'-phosphate · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13310.860.9654G1P, PLP
21470.760.9439empty
34120.730.8338empty
41300.550.8222empty
52090.540.7824G1P

Modifications

Observed in the structure: 1 cofactor (pyridoxal phosphate Schiff base).

Compared structures

  • 3GPB · Comparison of the binding of glucose and glucose-1-phosphate derivatives to T-state… · the same entry in another collection · chain A against A, TM-score 1.00

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