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Ligand · N3Q

N3Q · 2-[[3,5-bis(chloranyl)-4-(4~{H}-1,2,4-triazol-3-yl) phenyl]-(2-hydroxyethyl)amino]ethanol

N3Q, 2-[[3,5-bis(chloranyl)-4-(4~{H}-1,2,4-triazol-3-yl) phenyl]-(2-hydroxyethyl)amino]ethanol (C12 H14 Cl2 N4 O2, 317.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
N3Q
Formula
C12 H14 Cl2 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

N3Q in 2 structures; the first of them:

  • 6TDF · Crystal structure of Aspergillus fumigatus Glucosamine-6-phosphate N-acetyltransferase 1… · N3Q A202 · binds TYR94, VAL113, GLU115, HIS127, GLU129, ILE163, LEU164, ASP165
  • 6TDF · Crystal structure of aspergillus fumigatus glucosamine-6-phosphate N- acetyltransferase 1… · N3Q A202 · binds VAL113, GLU115, HIS127, GLU129, ILE163, LEU164, ASP165

Residues it binds most

GLU 2, ASP 2, HIS 2, ILE 2, LEU 2, VAL 2, TYR 1 (residue and the binding sites it lines).

Found with

  • ACO · Acetyl coenzyme *A
  • G6P · 6-O-phosphono-alpha-D-glucopyranose

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