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Ligand · H0D

H0D · N-(4-chlorophenyl)-N'-[(2R)-1-hydroxybutan-2-yl]urea

H0D, N-(4-chlorophenyl)-N'-[(2R)-1-hydroxybutan-2-yl]urea (C11 H15 Cl N2 O2, 242.7 g/mol), in the MolNFT structures on GenesisL1: bound in 5 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
H0D
Formula
C11 H15 Cl N2 O2
Class
ligand
Structures
5
PDB entries
3

Binding sites

H0D in 5 structures; the first of them:

  • 5QGS · PanDDA analysis group deposition of models with modelled events (e.g. bound ligands)… · H0D A305 · binds TYR41, ARG67, ILE116, ASP117, THR120, ILE122
  • 5RYS · EPB41L3 PanDDA analysis group deposition -- Crystal Structure of the FERM domain of human… · H0D A401 · binds ASP118, CYS206, LEU207, ARG210, TYR231, THR232, SER235, GLU236 and 3 more
  • 5QGS · Pandda analysis group deposition of models with modelled events (E.G. bound ligands)… · H0D A305 · binds TYR41, ARG67, ILE116, ASP117, ILE122
  • 5RX4 · INPP5D pandda analysis group deposition -- crystal structure of the phosphatase and C2… · H0D A901 · binds LEU620, ARG623, ARG624
  • 5RYS · EPB41L3 pandda analysis group deposition -- crystal structure of the ferm domain of human… · H0D A401 · binds ASP118, CYS206, LEU207, ARG210, TYR231, THR232, SER235, GLU236 and 3 more

Residues it binds most

ARG 5, ILE 3, GLU 3, ASP 4, THR 4, TYR 4, LEU 3, ALA 2, CYS 2, PHE 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide
  • ACT · Acetate ion
  • EDO · 1,2-ethanediol

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