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Ligand · 3B0

3B0 · 5-(trifluoromethyl)pyridin-2-amine

3B0, 5-(trifluoromethyl)pyridin-2-amine (C6 H5 F3 N2, 162.1 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 most and the ligands…

Component
3B0
Formula
C6 H5 F3 N2
Class
ligand
Structures
2
PDB entries
1

Binding sites

3B0 in 2 structures; the first of them:

  • 4TY9 · An Ligand-observed Mass Spectrometry-based Approach Integrated into the Fragment Based… · 3B0 A601 · binds GLU361, LEU362, ASN369, VAL370, SER371, THR385, SER478, GLY480 and 2 more
  • 4TY9 · An ligand-observed mass spectrometry-based approach integrated into the fragment based… · 3B0 A601 · binds GLU361, LEU362, ASN369, VAL370, SER371, THR385, SER478, GLY480 and 2 more

Residues it binds most

GLU 2, SER 2, ARG 2, ASN 2, GLY 2, LEU 2, THR 2, VAL 2 (residue and the binding sites it lines).

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