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Ligand · P6M

P6M · (4S,6R)-4-[2,4-difluoro-5-({[1-(trifluoromethyl) cyclopropyl]amino}methyl)phenyl]-4,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine

P6M, (4S,6R)-4-[2,4-difluoro-5-({[1-(trifluoromethyl) cyclopropyl]amino}methyl)phenyl]-4,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine (C17 H20 F5 N3 S, 393.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component
P6M
Formula
C17 H20 F5 N3 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

P6M in 1 structure; the first of them:

  • 5TFU · Structure of cytochrome P450 2D6 (CYP2D6) BACE1 inhibitor complex · P6M A604 · binds LEU110, PHE112, PHE120, LEU121, ALA209, LEU213, GLU216, GLN244 and 6 more

Residues it binds most

LEU 4, ALA 4, PHE 4, ASP 4, GLN 4, GLU 4, SER 4 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • ZN · Zinc ion

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