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Ligand · 2XT

2XT · propyl 2-(acetylamino)-4-O-{3-O-[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]-beta-D-galactopyranosyl}-2-deoxy-beta-D-glucopyranoside

2XT, propyl 2-(acetylamino)-4-O-{3-O-[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]-beta-D-galactopyranosyl}-2-deoxy-beta-D-glucopyranoside (C27 H40 N4 O11, 596.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
2XT
Formula
C27 H40 N4 O11
Class
ligand
Structures
2
PDB entries
1

Binding sites

2XT in 2 structures; the first of them:

  • 4Q1P · Galectin-1 in Complex with Ligand NB169 · 2XT A201 · binds SER29, VAL31, HIS44, ASN46, ARG48, HIS52, VAL59, ASN61 and 5 more
  • 4Q1P · Galectin-1 in complex with ligand NB169 · 2XT A201 · binds SER29, VAL31, HIS44, ASN46, ARG48, HIS52, VAL59, ASN61 and 5 more

Residues it binds most

ARG 4, ASN 4, HIS 4, ASP 4, GLY 4, VAL 4, GLU 4, SER 4, TRP 4, PHE 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • BME · Beta-mercaptoethanol

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