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Ligand · UKW

UKW · 4-ethynyl-N-[(1S,2R)-2-hydroxy-1-(oxocarbamoyl)propyl]benzamide

UKW, 4-ethynyl-N-[(1S,2R)-2-hydroxy-1-(oxocarbamoyl)propyl]benzamide (C13 H12 N2 O4, 260.2 g/mol), in the MolNFT structures on GenesisL1: bound in 10 records (5 PDB entries). Every binding site with its residues within 4.5 Å, the residues…

Component
UKW
Formula
C13 H12 N2 O4
Class
ligand
Structures
10
PDB entries
5

Binding sites

UKW in 10 structures; the first of them:

  • 3P3G · Crystal Structure of the Escherichia coli LpxC/LPC-009 complex · UKW A801 · binds MET61, PHE194, ASP197, TYR200, LEU201
  • 3PS1 · Crystal structure of the Escherichia Coli LPXC/LPC-011 complex · UKW A501 · binds MET61, PHE194, ASP197, TYR200, LEU201
  • 3PS2 · Crystal structure of the Escherichia Coli LPXC/LPC-012 complex · UKW A501 · binds MET61, PHE194, ASP197, TYR200, LEU201
  • 3PS3 · Crystal structure of the Escherichia Coli LPXC/LPC-053 complex · UKW A501 · binds MET61, PHE194, ASP197, TYR200, LEU201
  • 4MQY · Crystal Structure of the Escherichia coli LpxC/LPC-138 complex · UKW A409 · binds MET61, PHE194, ASP197, TYR200, LEU201
  • 3P3G · Crystal structure of the escherichia COLI LPXC/LPC-009 complex · UKW A801 · binds MET61, PHE194, ASP197, TYR200, LEU201
  • 3PS1 · Crystal structure of the escherichia COLI LPXC/LPC-011 complex · UKW A501 · binds MET61, PHE194, ASP197, TYR200, LEU201
  • 3PS2 · Crystal structure of the escherichia COLI LPXC/LPC-012 complex · UKW A501 · binds MET61, PHE194, ASP197, TYR200, LEU201
  • 3PS3 · Crystal structure of the escherichia COLI LPXC/LPC-053 complex · UKW A501 · binds MET61, PHE194, ASP197, TYR200, LEU201
  • 4MQY · Crystal structure of the escherichia COLI LPXC/LPC-138 complex · UKW A409 · binds MET61, PHE194, ASP197, TYR200, LEU201

Residues it binds most

ASP 10, LEU 10, MET 10, PHE 10, TYR 10 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • 2CW · 4-[4-(4-aminophenyl)buta-1,3-diyn-1-yl]-N-[(2S,3R)-3-hydroxy-2-methyl-1-nitroso-1-oxobutan-2-yl]benzamide
  • 3P3 · N-[(1S,2R)-2-hydroxy-1-(hydroxycarbamoyl)propyl]-4-(4-phenylbuta-1,3-diyn-1-yl)benzamide
  • L53 · 4-[4-(4-aminophenyl)buta-1,3-diyn-1-yl]-N-[(2S,3S)-3-hydroxy-1-nitroso-1-oxobutan-2-yl]benzamide
  • ZH2 · 4-[4-(4-aminophenyl)buta-1,3-diyn-1-yl]-N-[(2S,3R)-3-hydroxy-1-(hydroxyamino)-1-oxobutan-2-yl]benzamide
  • ZH4 · 4-[4-(3-aminophenyl)buta-1,3-diyn-1-yl]-N-[(2S,3R)-3-hydroxy-1-nitroso-1-oxobutan-2-yl]benzamide

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