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Ligand · 3RT

3RT · N~3~-(tetrahydro-2H-pyran-4-yl)-N~6~-[5-(tetrahydro-2H-pyran-4-ylmethyl)[1,2,4]triazolo[1,5-a]pyridin-2-yl]-1H-indazole-3,6-diamine

3RT, N~3~-(tetrahydro-2H-pyran-4-yl)-N~6~-[5-(tetrahydro-2H-pyran-4-ylmethyl)[1,2,4]triazolo[1,5-a]pyridin-2-yl]-1H-indazole-3,6-diamine (C24 H29 N7 O2, 447.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
3RT
Formula
C24 H29 N7 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

3RT in 2 structures; the first of them:

  • 4WNM · SYK catalytic domain in complex with a potent triazolopyridine inhibitor · 3RT A701 · binds LEU377, GLY378, VAL385, ALA400, VAL433, MET448, GLU449, MET450 and 12 more
  • 4WNM · Syk catalytic domain in complex with a potent triazolopyridine inhibitor · 3RT A701 · binds LEU377, GLY378, VAL385, ALA400, VAL433, MET448, GLU449, MET450 and 12 more

Residues it binds most

LEU 2, ALA 2, GLU 2, GLY 2, MET 2, VAL 2, ARG 2, ASN 2, ASP 2, GLN 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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