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Ligand · CNI

CNI · 7-nitro-2,3-dioxo-2,3-dihydroquinoxaline-6-carbonitrile

CNI, 7-nitro-2,3-dioxo-2,3-dihydroquinoxaline-6-carbonitrile (C9 H2 N4 O4, 230.1 g/mol), in the MolNFT structures on GenesisL1: bound in 8 records (4 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
CNI
Formula
C9 H2 N4 O4
Class
ligand
Structures
8
PDB entries
4

Binding sites

CNI in 8 structures; the first of them:

  • 3B7D · Crystal structure of the GLUR2 ligand binding core (HS1S2J) in complex with CNQX at 2.5 A… · CNI A262 · binds GLU13, TYR16, TYR61, PRO89, LEU90, THR91, ARG96, SER142 and 5 more
  • 3T9U · CNQX bound to an oxidized double cysteine mutant (A452C/S652C) of the ligand binding… · CNI A400 · binds GLU13, TYR16, TYR61, PRO89, LEU90, THR91, ARG96, LEU138 and 8 more
  • 3T9V · CNQX bound to a reduced double cysteine mutant (A452C/S652C) of the ligand binding domain… · CNI A400 · binds GLU13, TYR16, TYR61, PRO89, LEU90, THR91, ARG96, THR174 and 4 more
  • 4F1Y · CNQX bound to the ligand binding domain of GluA3 · CNI A401 · binds GLU13, TYR16, TYR61, PRO89, LEU90, THR91, ARG96, THR174 and 4 more
  • 3B7D · Crystal structure of the GLUR2 ligand binding core (HS1S2J) in complex with cnqx at 2.5 a… · CNI A262 · binds GLU13, TYR16, TYR61, PRO89, LEU90, THR91, ARG96, SER142 and 5 more
  • 3T9U · Cnqx bound to an oxidized double cysteine mutant (A452C/S652C) of the ligand binding… · CNI A400 · binds GLU13, TYR16, TYR61, PRO89, LEU90, THR91, ARG96, LEU138 and 8 more
  • 3T9V · Cnqx bound to a reduced double cysteine mutant (A452C/S652C) of the ligand binding domain… · CNI A400 · binds GLU13, TYR16, TYR61, PRO89, LEU90, THR91, ARG96, THR174 and 4 more
  • 4F1Y · Cnqx bound to the ligand binding domain of GLUA3 · CNI A401 · binds GLU13, TYR16, TYR61, PRO89, LEU90, THR91, ARG96, THR174 and 4 more

Residues it binds most

TYR 30, THR 30, GLU 30, LEU 30, ARG 30, MET 30, PRO 30, SER 14, GLY 6 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion

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