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Ligand · JCL

JCL · 4-(6-chloro-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl) butyl phosphate

JCL, 4-(6-chloro-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl) butyl phosphate (C8 H12 Cl N2 O6 P, 298.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
JCL
Formula
C8 H12 Cl N2 O6 P
Class
ligand
Structures
2
PDB entries
1

Binding sites

JCL in 2 structures; the first of them:

  • 2C97 · LUMAZINE SYNTHASE FROM MYCOBACTERIUM TUBERCULOSIS BOUND TO 4-(6… · JCL A701 · binds TRP27, HIS28, GLY58, ALA59, VAL81, VAL82, ILE83, ARG84 and 8 more
  • 2C97 · Lumazine synthase from mycobacterium tuberculosis bound to 4-(6… · JCL A701 · binds TRP27, HIS28, GLY58, ALA59, VAL81, VAL82, ILE83, ARG84 and 8 more

Residues it binds most

VAL 10, GLY 10, HIS 10, ARG 10, ALA 10, GLN 10, ILE 10, THR 10, TRP 10, PHE 8 (residue and the binding sites it lines).

Found with

  • K · Potassium ion
  • ACT · Acetate ion
  • DTD · Dithiane diol
  • MPD · (4S)-2-methyl-2,4-pentanediol

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