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Pyrone synthase (pys) from gerbera hybrida

Analyse Pyrone synthase (pys) from gerbera hybrida in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1QLV
Type
protein
Length
754 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pyrone synthase
EC
2.3.1.74
UniProt
P48391
Pockets
7 · best druggability 0.76

Structure

x-ray diffraction · 2 distinct chains · 43% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APyrone synthase (EC 2.3.1.74)protein37844% helix, 23% strandP48391
BPyrone synthase (EC 2.3.1.74)protein37642% helix, 23% strandP48391

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1920.760.9732empty
2790.730.9722empty
32170.600.8129empty
41540.590.8229empty
5530.390.8117empty

Interfaces

1 interface between chains.

  • A–B · 2380 Ų buried · 56 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (oxidation).

Compared structures

  • 1QLV · Pyrone synthase (PYS) from Gerbera hybrida · the same entry in another collection · chain A against A, TM-score 1.00
  • P48391 · AlphaFold monomer V2.0 prediction for 2-pyrone synthase (P48391) · a predicted model of the same protein · chain A against A, TM-score 1.00

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