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Ligand · BXE

BXE · [3-(2~{H}-1,2,3,4-tetrazol-5-yl)propanoylamino]azanium

BXE, [3-(2~{H}-1,2,3,4-tetrazol-5-yl)propanoylamino]azanium (C4 H9 N6 O +1, 157.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
BXE
Formula
C4 H9 N6 O +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

BXE in 2 structures; the first of them:

  • 6ETV · Crystal structure of KDM4D with tetrazolhydrazide compound 2 · BXE A413 · binds TYR136, TYR181, PHE189, HIS192, GLU194, SER200, ASN202, LYS210 and 2 more
  • 6ETV · Crystal structure of KDM4D with tetrazolhydrazide compound 2 · BXE A413 · binds TYR136, TYR181, PHE189, HIS192, GLU194, SER200, ASN202, LYS210 and 2 more

Residues it binds most

HIS 2, TYR 2, ASN 2, GLU 2, LYS 2, PHE 2, SER 2, TRP 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • NI · Nickel (II) ion
  • ZN · Zinc ion
  • CL · Chloride ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid
  • GOL · Glycerol

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