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Ligand · X1N

X1N · 2-methyl-N-[(1Z)-3-nitrocyclohexa-2,4-dien-1-ylidene]-4,5-dihydro[1,3]thiazolo[4,5-h]quinazolin-8-amine

X1N, 2-methyl-N-[(1Z)-3-nitrocyclohexa-2,4-dien-1-ylidene]-4,5-dihydro[1,3]thiazolo[4,5-h]quinazolin-8-amine (C16 H13 N5 O2 S, 339.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
X1N
Formula
C16 H13 N5 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

X1N in 2 structures; the first of them:

  • 2X1N · Truncation and Optimisation of Peptide Inhibitors of CDK2, Cyclin A Through Structure… · X1N A1297 · binds ILE10, GLU12, GLY13, VAL18, ALA31, LYS33, VAL64, PHE80 and 10 more
  • 2X1N · Truncation and optimisation of peptide inhibitors of CDK2, cyclin a through structure… · X1N A1297 · binds ILE10, GLU12, GLY13, VAL18, ALA31, LYS33, VAL64, PHE80 and 10 more

Residues it binds most

ASP 4, GLU 4, LEU 4, LYS 4, PHE 4, VAL 4, GLN 4, ALA 4, GLY 4, HIS 4 (residue and the binding sites it lines).

Found with

  • ACE · Acetyl group
  • NH2 · Amino group

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