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Ligand · 3BX

3BX · N-hydroxy-4-[(4-{[4-(morpholin-4-ylmethyl)phenyl]ethynyl}phenoxy)methyl]tetrahydro-2H-pyran-4-carboxamide

3BX, N-hydroxy-4-[(4-{[4-(morpholin-4-ylmethyl)phenyl]ethynyl}phenoxy)methyl]tetrahydro-2H-pyran-4-carboxamide (C26 H30 N2 O5, 450.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
3BX
Formula
C26 H30 N2 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

3BX in 2 structures; the first of them:

  • 4U3D · LpxC from A.Aaeolicus in complex with 4-[[4-[2-[4-(morpholinomethyl)phenyl]ethynyl]phenoxy… · 3BX A305 · binds ILE18, HIS19, HIS58, GLU73, HIS74, THR179, PHE180, ALA181 and 14 more
  • 4U3D · Lpxc from A.AAEOLICUS in complex with 4-[[4-[2-[4-(morpholinomethyl)… · 3BX A305 · binds ILE18, HIS19, HIS58, GLU73, HIS74, THR179, PHE180, ALA181 and 14 more

Residues it binds most

HIS 2, ILE 2, GLY 2, LYS 2, THR 2, ALA 2, ASP 2, GLU 2, LEU 2, PHE 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • CL · Chloride ion
  • IMD · Imidazole

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