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Ligand · G6I

G6I · N-{3-[(3-{4-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl}pyridin-2-yl)amino]-4-methylphenyl}-3-(trifluoromethyl)benzamide

G6I, N-{3-[(3-{4-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl}pyridin-2-yl)amino]-4-methylphenyl}-3-(trifluoromethyl)benzamide (C30 H24 F3 N7 O2, 571.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
G6I
Formula
C30 H24 F3 N7 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

G6I in 2 structures; the first of them:

  • 4EQU · Human STK-10 (LOK) kinase domain in DFG-out conformation with inhibitor DSA-7 · G6I A401 · binds LEU42, VAL50, ALA63, ALA64, LYS65, GLU81, ILE84, LEU85 and 19 more
  • 4EQU · Human stk-10 (lok) kinase domain in dfg-out conformation with inhibitor dsa-7 · G6I A401 · binds LEU42, VAL50, ALA63, ALA64, LYS65, GLU81, ILE84, LEU85 and 19 more

Residues it binds most

LEU 4, ILE 4, ALA 4, CYS 4, GLU 4, LYS 4, PHE 4, VAL 4, ASP 4, GLY 4 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • 1PE · Pentaethylene glycol

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