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Ligand · Q1L

Q1L · (2R,3R,4R,5R,6S)-2-(hydroxymethyl)-6-[2-(2-methyl-1,3-benzothiazol-6-yl)-1,2,4-triazol-3-yl]-4-[4-[3,4,5-tris(fluoranyl)phenyl]-1,2,3-triazol-1-yl]oxane-3,5-diol

Q1L, (2R,3R,4R,5R,6S)-2-(hydroxymethyl)-6-[2-(2-methyl-1,3-benzothiazol-6-yl)-1,2,4-triazol-3-yl]-4-[4-[3,4,5-tris(fluoranyl)phenyl]-1,2,3-triazol-1-yl]oxane-3,5-diol (C24 H20 F3 N7 O4 S, 559.5 g/mol), in the MolNFT structures on…

Component
Q1L
Formula
C24 H20 F3 N7 O4 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

Q1L in 1 structure; the first of them:

  • 8ILU · Crystal structure of mouse Galectin-3 in complex with small molecule inhibitor · Q1L A301 · binds ARG158, ILE159, VAL160, HIS172, ASN174, ARG176, VAL186, ASN188 and 5 more

Residues it binds most

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

Found with

  • NA · Sodium ion
  • SCN · Thiocyanate ion

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