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MolNFT v1 · #17727 · protein

Crystal structure of glycogen phosphorylase B in complex with maltoheptaose

1P2B · Glycogen phosphorylase, muscle form: “Crystal structure of glycogen phosphorylase B in complex with maltoheptaose”. X-ray diffraction, 2 ligands (PLP, GLC), 10 pockets (best druggability 0.85). MolNFT v1 #17727 on GenesisL1: 3D…

PDB
1P2B
Type
protein
Length
808 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, GLC
Pockets
10 · 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)protein80852% helix, 15% strandP00489

Ligands and binding sites

  • PLP · Pyridoxal-5'-phosphate · ligand · chains A
  • GLC · alpha-D-glucopyranose · sugar · 5 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12950.850.9659PLP
21460.800.9743empty
34950.710.8168empty
41100.520.8219empty
51130.490.8024empty

Modifications

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

Compared structures

  • 1P2B · Crystal Structure of Glycogen Phosphorylase B in Complex with Maltoheptaose · the same entry in another collection · chain A against A, TM-score 1.00

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