Ligand · I1G
I1G · 3-[4-[5-[4-[[4-(acetamidomethyl)piperidin-1-ium-1-yl]methyl]-6-[3,5-bis(chloranyl)phenyl]pyridin-2-yl]oxypyrimidin-2-yl]piperazin-1-ium-1-yl]propanoate
I1G, 3-[4-[5-[4-[[4-(acetamidomethyl)piperidin-1-ium-1-yl]methyl]-6-[3,5-bis(chloranyl)phenyl]pyridin-2-yl]oxypyrimidin-2-yl]piperazin-1-ium-1-yl]propanoate (C31 H38 Cl2 N7 O4 +1, 643.6 g/mol), in the MolNFT structures on GenesisL1: bound…
- Component
- I1G
- Formula
- C31 H38 Cl2 N7 O4 +1
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
I1G in 2 structures; the first of them:
- 7QXY · X-ray structure of furin in complex with the dichlorophenylpyridine-based inhibitor 3 · I1G A609 · binds LEU152, ASP191, HIS194, MET226, LEU227, VAL231, THR232, ASP233 and 12 more
- 7QXY · X-ray structure of furin in complex with the dichlorophenylpyridine- based inhibitor 3 · I1G A609 · binds LEU152, ASP191, HIS194, MET226, LEU227, VAL231, ASP233, GLU236 and 10 more
Residues it binds most
ASP 2, LEU 2, ALA 2, GLY 2, TRP 2, GLU 2, HIS 2, MET 2, PRO 2, TYR 2 (residue and the binding sites it lines).
Found with
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