GL1X · GenesisL1 explorer

Ligand · A82

A82 · 2-[[(1R)-1-(7-methyl-2-morpholin-4-yl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-9-yl)ethyl]amino]benzoic acid

A82, 2-[[(1R)-1-(7-methyl-2-morpholin-4-yl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-9-yl)ethyl]amino]benzoic acid (C22 H24 N4 O4, 408.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site…

Component
A82
Formula
C22 H24 N4 O4
Class
ligand
Structures
4
PDB entries
2

Binding sites

A82 in 4 structures; the first of them:

  • 4URK · PI3Kg in complex with AZD6482 · A82 A2092 · binds LYS802, VAL803, MET804, PRO810, LEU811, TRP812, ILE831, LYS833 and 12 more
  • 6YVF · Structure of SARS-CoV-2 Main Protease bound to AZD6482. · A82 A401 · binds VAL35, ASN63, ILE78, GLY79, HIS80, SER81, LYS88, LEU89 and 1 more
  • 4URK · PI3KG in complex with AZD6482 · A82 A2092 · binds LYS802, VAL803, MET804, PRO810, LEU811, TRP812, ILE831, LYS833 and 12 more
  • 6YVF · Structure of SARS-cov-2 main protease bound to AZD6482. · A82 A401 · binds VAL35, ASN63, ILE78, GLY79, HIS80, SER81, LYS88, LEU89 and 1 more

Residues it binds most

ILE 4, LYS 4, VAL 4, ASP 2, LEU 4, MET 2, ASN 2, GLU 2, GLY 2, HIS 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • CL · Chloride ion
  • DMS · Dimethyl sulfoxide
  • PEG · Di(hydroxyethyl)ether

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