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Ligand · N8Q

N8Q · 4-[[(2~{S})-oxolan-2-yl]methyl]-3-pyridin-3-yl-1~{H}-1, 2,4-triazole-5-thione

N8Q, 4-[[(2~{S})-oxolan-2-yl]methyl]-3-pyridin-3-yl-1~{H}-1, 2,4-triazole-5-thione (C12 H14 N4 O S, 262.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
N8Q
Formula
C12 H14 N4 O S
Class
ligand
Structures
1
PDB entries
1

Binding sites

N8Q in 1 structure; the first of them:

  • 6TGD · Crystal structure of ndm-1 in complex with triazole-based inhibitor OP31 · N8Q A305 · binds MET67, VAL73, TRP93, HIS120, HIS122, GLN123, ASP124, HIS189 and 3 more

Residues it binds most

HIS 2, ASP 2, CYS 2, GLN 2, MET 2, TRP 2, ASN 1, VAL 1 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • ZN · Zinc ion

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