GL1X · GenesisL1 explorer

Ligand · 3XC

3XC · 6-{[(3R,4R)-4-(2-{[2,2-difluoro-2-(4-fluorophenyl)ethyl]amino}ethoxy)pyrrolidin-3-yl]methyl}-4-methylpyridin-2-amine

3XC, 6-{[(3R,4R)-4-(2-{[2,2-difluoro-2-(4-fluorophenyl)ethyl]amino}ethoxy)pyrrolidin-3-yl]methyl}-4-methylpyridin-2-amine (C21 H27 F3 N4 O, 408.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
3XC
Formula
C21 H27 F3 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

3XC in 2 structures; the first of them:

  • 3NLY · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · 3XC A800 · binds MET336, LEU337, ARG414, GLN478, PRO565, VAL567, PHE584, SER585 and 6 more
  • 3NLY · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · 3XC A800 · binds MET336, LEU337, ARG414, GLN478, PRO565, VAL567, PHE584, SER585 and 6 more

Residues it binds most

TRP 4, ARG 4, GLN 4, GLU 4, GLY 4, LEU 4, MET 4, PHE 4, PRO 4, SER 4 (residue and the binding sites it lines).

Found with

  • H4B · 5,6,7,8-tetrahydrobiopterin
  • HEM · Protoporphyrin IX containing Fe
  • ZN · Zinc ion
  • ACT · Acetate ion

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