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Ligand · HC7

HC7 · (2S)-2-[4'-({dimethyl[2-(phosphonooxy)ethyl]ammonio}acetyl)biphenyl-4-yl]-2-hydroxy-4,4-dimethylmorpholin-4-ium

HC7, (2S)-2-[4'-({dimethyl[2-(phosphonooxy)ethyl]ammonio}acetyl)biphenyl-4-yl]-2-hydroxy-4,4-dimethylmorpholin-4-ium (C24 H35 N2 O7 P +2, 494.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every…

Component
HC7
Formula
C24 H35 N2 O7 P +2
Class
ligand
Structures
4
PDB entries
2

Binding sites

HC7 in 4 structures; the first of them:

  • 3FEG · Crystal structure of human choline kinase beta in complex with phosphorylated… · HC7 A1 · binds ASP242, GLN244, ASN247, ASP264, GLU266, TYR267, GLU283, TYR288 and 8 more
  • 3LQ3 · Crystal structure of human choline kinase beta in complex with phosphorylated… · HC7 A396 · binds ASP242, GLN244, ASN247, ASP264, GLU266, TYR267, GLU283, TYR288 and 8 more
  • 3FEG · Crystal structure of human choline kinase beta in complex with phosphorylated… · HC7 A1 · binds ASP242, GLN244, ASN247, ASP264, GLU266, TYR267, GLU283, TYR288 and 8 more
  • 3LQ3 · Crystal structure of human choline kinase beta in complex with phosphorylated… · HC7 A396 · binds ASP242, GLN244, ASN247, ASP264, GLU266, TYR267, GLU283, TYR288 and 8 more

Residues it binds most

TYR 4, GLU 4, ASP 4, PHE 4, TRP 4, ARG 4, ASN 4, GLN 4 (residue and the binding sites it lines).

Found with

  • ADP · Adenosine-5'-diphosphate
  • AMP · Adenosine monophosphate
  • MG · Magnesium ion
  • SO4 · Sulfate ion
  • UNX · Unknown atom or ion

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