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Scoe with the caba substrate bound and alpha-ketoglutarate in an off- site

Analyse Scoe with the caba substrate bound and alpha-ketoglutarate in an off- site in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6XOJ
Type
protein
Length
296 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Scoe protein
UniProt
A0A3B6UEU3
Ligands
7UC, AKG, FE
Pockets
2 · best druggability 0.84

Structure

x-ray diffraction · 1 distinct chain · 22% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AScoe proteinprotein29622% helix, 26% strandA0A3B6UEU3

Ligands and binding sites

  • 7UC · (3~{R})-3-(2-hydroxy-2-oxoethylamino)butanoic acid · ligand · chains A
  • AKG · 2-oxoglutaric acid · ligand · chains A
  • FE · Fe (III) ion · metal · chains A
  • ACT · Acetate ion · additive · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13320.840.94557UC, AKG, FE
2670.310.7520empty

Compared structures

  • 6XOJ · ScoE with the CABA substrate bound and alpha-ketoglutarate in an off-site · the same entry in another collection · chain A against A, TM-score 1.00

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