Ligand · 6IO

6IO · ~{N}1,~{N}4-bis[2-(trifluoromethyl)pyrimidin-4-yl]cyclohexane-1,4-diamine

6IO, ~{N}1,~{N}4-bis[2-(trifluoromethyl)pyrimidin-4-yl]cyclohexane-1,4-diamine (C16 H16 F6 N6, 406.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component: 6IO
Formula: C16 H16 F6 N6
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

6IO in 2 structures; the first of them:

7PAV · MALT1 in complex with compound 1 · 6IO B801 · binds VAL344, ALA345, LYS379, VAL380, VAL381, LEU383, LEU386, GLU390 and 12 more
7PAV · MALT1 in complex with compound 1 · 6IO B801 · binds VAL344, LYS379, VAL381, LEU383, LEU386, GLU390, ASN393, ALA394 and 9 more

Residues it binds most

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

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