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Blood group synthase aaglyb in complex with udp-gal and cryoprotected with peg 3350

Analyse Blood group synthase aaglyb in complex with udp-gal and cryoprotected with peg… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6GX0
Type
protein
Length
288 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Abo blood group (transferase a, alpha 1-3-N- acetylgalactosaminyltransferase transferase…
UniProt
F0X360
Ligands
GDU, MN, SO4
Pockets
1 · best druggability 0.63

Structure

x-ray diffraction · 1 distinct chain · 33% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAbo blood group (transferase a, alpha 1-3-N- acetylgalactosaminyltransferase transferase B, alpha 1-3- galactosyltransferase)protein28833% helix, 19% strandF0X360

Ligands and binding sites

  • GDU · Galactose-uridine-5'-diphosphate · ligand · chains A
  • MN · Manganese (II) ion · metal · chains A
  • SO4 · Sulfate ion · ion · 3 copies · chains A
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A
  • PEG · Di(hydroxyethyl)ether · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13490.630.7833MN, GDU

Compared structures

  • 6GX0 · Blood group synthase AAGlyB in complex with UDP-Gal and cryoprotected with PEG 3350 · the same entry in another collection · chain A against A, TM-score 1.00

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