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Crystal structure of human galactosyltransferase (gtb) complexed with H type I trisaccharide

Analyse Crystal structure of human galactosyltransferase (gtb) complexed with H type I… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1ZJ2
Type
protein
Length
263 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
UniProt
P16442
Ligands
UDP, NAG, GAL, FUC, HG, MN, CL
Pockets
2 · best druggability 0.54

Structure

x-ray diffraction · 1 distinct chain · 30% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAbo blood group (transferase a, alpha 1-3-N- acetylgalactosaminyltransferaseprotein26330% helix, 22% strandP16442

Ligands and binding sites

  • UDP · Uridine-5'-diphosphate · ligand · chains A
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · chains A
  • GAL · beta-D-galactopyranose · sugar · chains A
  • FUC · alpha-L-fucopyranose · sugar · chains A
  • HG · Mercury (II) ion · metal · 6 copies · chains A
  • MN · Manganese (II) ion · metal · chains A
  • CL · Chloride ion · ion · 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
12820.540.7530GAL, UDP, HG, CL
2500.290.7614FUC

Compared structures

  • 1ZJ2 · Crystal Structure of Human Galactosyltransferase (GTB) Complexed with H type I… · the same entry in another collection · chain A against A, TM-score 1.00
  • P16442 · AlphaFold monomer V2.0 prediction for histo-blood group abo system transferase (P16442) · a predicted model of the same protein · chain A against A, TM-score 1.00

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