Ligand · UPH

UPH · (2R,3R,4R,5S)-2-(hydroxymethyl)-1-(6-{2-nitro-4-[(1R,5S)-3-oxa-8-azabicyclo[3.2.1]octan-8-yl]anilino}hexyl)piperidine-3,4,5-triol

UPH, (2R,3R,4R,5S)-2-(hydroxymethyl)-1-(6-{2-nitro-4-[(1R,5S)-3-oxa-8-azabicyclo[3.2.1]octan-8-yl]anilino}hexyl)piperidine-3,4,5-triol (C24 H38 N4 O7, 494.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component: UPH
Formula: C24 H38 N4 O7
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

UPH in 1 structure; the first of them:

8E5U · Co-crystal structure of Chaetomium glucosidase with compound 9 · UPH A901 · binds PRO412, PHE416, PHE417, ARG419, PHE421, TRP423, ASP424, LYS470 and 11 more

Residues it binds most

PHE 2, TRP 2, ASP 2, PRO 2, GLU 2, ARG 2, GLY 2, LYS 2, TYR 2, VAL 2 (residue and the binding sites it lines).

Found with

NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
SO4 · Sulfate ion
BTB · 2-[bis-(2-hydroxy-ethyl)-amino]-2-hydroxymethyl-propane-1,3-diol
GOL · Glycerol

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