GL1X · GenesisL1 explorer

Ligand · 3B9

3B9 · N-[2-(2,4-diaminopyrido[2,3-d]pyrimidin-7-yl)-2-methylpropyl]-4-phenoxybenzamide

3B9, N-[2-(2,4-diaminopyrido[2,3-d]pyrimidin-7-yl)-2-methylpropyl]-4-phenoxybenzamide (C24 H24 N6 O2, 428.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5…

Component
3B9
Formula
C24 H24 N6 O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

3B9 in 4 structures; the first of them:

  • 3BA9 · Structural Basis for Inhbition of NAD-Dependent Ligase · 3B9 A501 · binds ILE84, PRO85, MET86, TYR87, SER88, LEU89, GLU118, LEU119 and 10 more
  • 3BAC · Structural Basis for the Inhibition of Bacterial NAD+ Dependent DNA Ligase · 3B9 A501 · binds ILE77, PRO78, MET79, LEU80, SER81, LEU82, GLU114, PRO115 and 7 more
  • 3BA9 · Structural basis for inhbition of NAD-dependent ligase · 3B9 A501 · binds ILE84, PRO85, MET86, TYR87, SER88, LEU89, GLU118, LEU119 and 10 more
  • 3BAC · Structural basis for the inhibition of bacterial NAD+ dependent DNA ligase · 3B9 A501 · binds ILE77, PRO78, MET79, LEU80, SER81, LEU82, GLU114, PRO115 and 7 more

Residues it binds most

GLU 4, LEU 4, LYS 4, PRO 4, TYR 4, ARG 4, ILE 4, MET 4, PHE 4, SER 4 (residue and the binding sites it lines).

Found with

  • NMN · Beta-nicotinamide ribose monophosphate
  • PO4 · Phosphate ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.