Ligand · XEX

XEX · (3R)-3-(3-bromophenyl)-3-(2-{2-[(3,3-difluoroazetidin-1-yl)methyl]-6-methoxyphenoxy}acetamido)-N-methylpropanamide

XEX, (3R)-3-(3-bromophenyl)-3-(2-{2-[(3,3-difluoroazetidin-1-yl)methyl]-6-methoxyphenoxy}acetamido)-N-methylpropanamide (C23 H26 Br F2 N3 O4, 526.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every…

Component: XEX
Formula: C23 H26 Br F2 N3 O4
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

XEX in 1 structure; the first of them:

7G31 · Crystal Structure of rat Autotaxin in complex with… · XEX A901 · binds LEU78, SER81, ILE167, SER169, PHE210, LEU213, TYR214, LEU216 and 13 more

Residues it binds most

LEU 1, PHE 1, TRP 1, ALA 1, SER 1, TYR 1, VAL 1, ILE 1, LYS 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
BR · Bromide ion
CL · Chloride ion
ACT · Acetate ion

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