Ligand · XSQ

XSQ · (5M)-5-[4-(cyclopropylmethoxy)naphthalen-2-yl]-4-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one

XSQ, (5M)-5-[4-(cyclopropylmethoxy)naphthalen-2-yl]-4-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one (C17 H17 N3 O2, 295.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component: XSQ
Formula: C17 H17 N3 O2
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

XSQ in 1 structure; the first of them:

7G47 · Crystal Structure of rat Autotaxin in complex with… · XSQ A901 · binds ILE167, SER169, PHE210, LEU213, TYR214, ALA217, TRP254, TRP260 and 6 more

Residues it binds most

PHE 1, TRP 1, ALA 1, TYR 1, ILE 1, LEU 1, SER 1 (residue and the binding sites it lines).

Found with

CA · Calcium ion
NA · Sodium ion
ZN · Zinc ion
BMA · beta-D-mannopyranose
MAN · alpha-D-mannopyranose
NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
CL · Chloride ion

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