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Ligand · F0P

F0P · (2~{S})-5-[2-(3-aminocarbonylphenyl)ethyl-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]amino]-2-azanyl-pentanoic acid

F0P, (2~{S})-5-[2-(3-aminocarbonylphenyl)ethyl-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]amino]-2-azanyl-pentanoic acid (C24 H32 N8 O6, 528.6 g/mol), in the MolNFT structures on GenesisL1: bound…

Component
F0P
Formula
C24 H32 N8 O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

F0P in 2 structures; the first of them:

  • 6CHH · Structure of human NNMT in complex with bisubstrate inhibitor MS2756 · F0P A301 · binds LYS8, TYR11, PHE15, TYR20, TYR24, TYR25, GLY63, SER64 and 26 more
  • 6CHH · Structure of human nnmt in complex with bisubstrate inhibitor MS2756 · F0P A301 · binds LYS8, TYR11, PHE15, TYR20, TYR24, TYR25, GLY63, SER64 and 26 more

Residues it binds most

TYR 8, ALA 8, ASP 8, SER 8, THR 8, CYS 8, GLY 8, ASN 8, GLN 8, LEU 8 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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