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MolNFT v1 · #24591 · protein

Glycogen phosphorylase B in complex with indirubin-5'-sulphonate

1UZU · Glycogen phosphorylase, muscle form: “Glycogen phosphorylase B in complex with indirubin-5'-sulphonate”. X-ray diffraction, 2 ligands (PLP, INR), 14 pockets (best druggability 0.85). MolNFT v1 #24591 on GenesisL1: 3D structure…

PDB
1UZU
Type
protein
Length
809 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
PLP, INR
Pockets
14 · best druggability 0.85

Structure

x-ray diffraction · 1 distinct chain · 52% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlycogen phosphorylase, muscle form (EC 2.4.1.1)protein80952% helix, 15% strandP00489

Ligands and binding sites

  • PLP · Pyridoxal-5'-phosphate · ligand · chains A
  • INR · 2',3-dioxo-1,1',2',3-tetrahydro-2,3'-biindole-5'-sulfonic acid · 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, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12830.850.9661PLP
21500.790.9638empty
32750.680.8436empty
41180.530.8218empty
52260.510.7621empty

Modifications

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

Compared structures

  • 1UZU · Glycogen Phosphorylase b in complex with indirubin-5'-sulphonate · the same entry in another collection · chain A against A, TM-score 1.00

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