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Ligand · BUH

BUH · ~{N}-[6-[(3~{R},6~{R})-5-azanyl-3,6-dimethyl-6-(trifluoromethyl)-2~{H}-1,4-oxazin-3-yl]-5-fluoranyl-pyridin-2-yl]-3-chloranyl-5-(trifluoromethyl)pyridine-2-carboxamide

BUH, ~{N}-[6-[(3~{R},6~{R})-5-azanyl-3,6-dimethyl-6-(trifluoromethyl)-2~{H}-1,4-oxazin-3-yl]-5-fluoranyl-pyridin-2-yl]-3-chloranyl-5-(trifluoromethyl)pyridine-2-carboxamide (C19 H15 Cl F7 N5 O2, 513.8 g/mol), in the MolNFT structures on…

Component
BUH
Formula
C19 H15 Cl F7 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

BUH in 2 structures; the first of them:

  • 6EQM · Crystal Structure of Human BACE-1 in Complex with CNP520 · BUH A401 · binds GLY11, GLN12, GLY13, TYR14, LEU30, ASP32, GLY34, SER35 and 11 more
  • 6EQM · Crystal structure of human bace-1 in complex with CNP520 · BUH A401 · binds GLY11, GLN12, GLY13, TYR14, LEU30, ASP32, GLY34, SER35 and 11 more

Residues it binds most

GLY 2, ASP 2, ILE 2, SER 2, THR 2, TYR 2, ALA 2, GLN 2, LEU 2, PHE 2 (residue and the binding sites it lines).

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