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Ligand · NVY

NVY · 1-ethyl-N-(2-fluorophenyl)piperidin-4-amine

NVY, 1-ethyl-N-(2-fluorophenyl)piperidin-4-amine (C13 H19 F N2, 222.3 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (4 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
NVY
Formula
C13 H19 F N2
Class
ligand
Structures
6
PDB entries
4

Binding sites

NVY in 6 structures; the first of them:

  • 5QSH · PanDDA analysis group deposition -- Crystal Structure of human Brachyury G177D variant in… · NVY A301 · binds GLU48, GLU50, LEU51, ARG54, TYR210
  • 5RYZ · EPB41L3 PanDDA analysis group deposition -- Crystal Structure of the FERM domain of human… · NVY A401 · binds LYS291, LYS292, LEU293, SER294, CYS316, SER318, GLY319, LEU320 and 4 more
  • 5QRB · Pandda analysis group deposition -- crystal structure of human ALAS2A in complex with… · NVY B602 · binds TRP171, ASP173, ALA174, PHE177, ASP190
  • 5QSH · Pandda analysis group deposition -- crystal structure of human brachyury G177D variant in… · NVY A301 · binds GLU48, GLU50, LEU51, ARG54, TYR210
  • 5RXC · INPP5D pandda analysis group deposition -- crystal structure of the phosphatase and C2… · NVY A901 · binds LEU620, ARG623, ARG624, GLU633
  • 5RYZ · EPB41L3 pandda analysis group deposition -- crystal structure of the ferm domain of human… · NVY A401 · binds LYS291, LYS292, LEU293, SER294, CYS316, SER318, GLY319, LEU320 and 4 more

Residues it binds most

LEU 5, ARG 5, GLU 4, LYS 3, SER 2, ALA 3, PHE 3, ASP 1, CYS 2, GLY 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol
  • PLP · Pyridoxal-5'-phosphate

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