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Glycogen phosphorylase B in complex with 28

Analyse Glycogen phosphorylase B in complex with 28 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6QA8
Type
protein
Length
806 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycogen phosphorylase, muscle form
EC
2.4.1.1
UniProt
P00489
Ligands
HTE, PLP
Pockets
13 · best druggability 0.87

Structure

x-ray diffraction · 1 distinct chain · 53% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlycogen phosphorylase, muscle form (EC 2.4.1.1)protein80653% helix, 16% strandP00489

Ligands and binding sites

  • HTE · (5~{S},7~{R},8~{S},9~{S},10~{R})-7-(hydroxymethyl)-8,9, 10-tris(oxidanyl)-2-phenyl-6-oxa-1,3-diazaspiro[4.5]dec-1-en-4-one · ligand · 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

13 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14850.870.9362HTE, PLP
2770.710.9529empty
33400.690.8338empty
42000.550.7925empty
5960.510.8320empty

Modifications

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

Compared structures

  • 6QA8 · Glycogen Phosphorylase b in complex with 28 · the same entry in another collection · chain A against A, TM-score 1.00

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