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Ligand · I6C

I6C · 3-{(4S)-2-[(cyclopropanecarbonyl)amino]imidazo[1,2-b]pyridazin-6-yl}-N-{3-[(4-ethylpiperazin-1-yl)methyl]-5-(trifluoromethyl)phenyl}-4-methylbenzamide

I6C, 3-{(4S)-2-[(cyclopropanecarbonyl)amino]imidazo[1,2-b]pyridazin-6-yl}-N-{3-[(4-ethylpiperazin-1-yl)methyl]-5-(trifluoromethyl)phenyl}-4-methylbenzamide (C32 H34 F3 N7 O2, 605.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1…

Component
I6C
Formula
C32 H34 F3 N7 O2
Class
ligand
Structures
1
PDB entries
1

Binding sites

I6C in 1 structure; the first of them:

  • 7TEU · Crystal structure of JAK2 JH1 with type II inhibitor YLIU-04-105-1 · I6C A1201 · binds LEU855, VAL863, ALA880, LYS882, GLU898, LEU902, LEU905, ILE910 and 16 more

Residues it binds most

LEU 1, ASP 1, GLU 1, GLY 1, ILE 1, TYR 1, VAL 1, ALA 1, HIS 1, LYS 1 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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