Ligand · XLQ

XLQ · 2-azanyl-4-(trifluoromethyl)-6-[[(1~{R},3~{S})-3-(trifluoromethyl)cyclohexyl]methyl]-7~{H}-pyrrolo[3,4-d]pyrimidin-5-one

XLQ, 2-azanyl-4-(trifluoromethyl)-6-[[(1~{R},3~{S})-3-(trifluoromethyl)cyclohexyl]methyl]-7~{H}-pyrrolo[3,4-d]pyrimidin-5-one (C15 H16 F6 N4 O, 382.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every…

Component: XLQ
Formula: C15 H16 F6 N4 O
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

XLQ in 1 structure; the first of them:

8R2A · CpKRS complexed with lysine and an inhibitor · XLQ A701 · binds ASN293, ARG295, GLU297, THR302, HIS303, ASN304, PHE307, ALA309 and 13 more

Residues it binds most

ASN 4, GLU 4, ARG 4, GLY 4, LEU 4, ILE 4, ALA 4, ASP 4, CYS 4, HIS 4 (residue and the binding sites it lines).

Found with

LYS · Lysine
SO4 · Sulfate ion
DMS · Dimethyl sulfoxide
GOL · Glycerol

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