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Ligand · AXX

AXX · 2-[(cyclopropylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

AXX, 2-[(cyclopropylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (C13 H16 N2 O2 S, 264.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
AXX
Formula
C13 H16 N2 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

AXX in 2 structures; the first of them:

  • 2PZI · Crystal Structure of Protein kinase PknG from Mycobacterium tuberculosis in Complex with… · AXX A753 · binds ILE86, ALA91, ILE157, ALA158, ILE165, VAL179, LYS181, VAL211 and 9 more
  • 2PZI · Crystal structure of protein kinase pkng from mycobacterium tuberculosis in complex with… · AXX A753 · binds ILE86, ALA91, ILE157, ALA158, ILE165, VAL179, LYS181, VAL211 and 9 more

Residues it binds most

ILE 4, VAL 4, ALA 4, GLY 4, MET 4, ASP 4, GLU 4, LYS 4, TYR 4 (residue and the binding sites it lines).

Found with

  • CD · Cadmium ion
  • CL · Chloride ion
  • GOL · Glycerol

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