GL1X · GenesisL1 explorer

Ligand · A1AQS

A1AQS · N-(4-{[(4S)-3-amino[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}phenyl)acetamide

A1AQS, N-(4-{[(4S)-3-amino[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}phenyl)acetamide (C13 H12 N6 O S, 300.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within…

Component
A1AQS
Formula
C13 H12 N6 O S
Class
ligand
Structures
2
PDB entries
2

Binding sites

A1AQS in 2 structures; the first of them:

  • 9BN8 · Crystal Structure of UDP-N-acetylmuramoylalanine--D-glutamate ligase (MurD) from E. coli… · A1AQS A502 · binds PHE189, GLN192, GLN193
  • 9BN9 · Crystal Structure of UDP-N-acetylmuramoylalanine--D-glutamate ligase (MurD) from E. coli… · A1AQS A502 · binds ALA102, ALA104, PRO105, GLN170, ALA171, VAL172, ASN204, ALA205 and 1 more

Residues it binds most

GLN 3, ALA 1, PHE 2, ASN 1, LYS 1, PRO 1, VAL 1 (residue and the binding sites it lines).

Found with

  • UMA · Uridine-5'-diphosphate-N-acetylmuramoyl-L-alanine
  • SO4 · Sulfate ion
  • GOL · Glycerol
  • CL · Chloride ion

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.