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Ligand · OJQ

OJQ · [2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl-(3-oxidanyl-1,2-oxazol-4-yl)azanium

OJQ, [2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl-(3-oxidanyl-1,2-oxazol-4-yl)azanium (C11 H15 N3 O7 P +1, 332.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
OJQ
Formula
C11 H15 N3 O7 P +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

OJQ in 2 structures; the first of them:

  • 6SCZ · Mycobacterium tuberculosis alanine racemase inhibited by DCS · OJQ A426 · binds VAL42, LYS44, TYR48, TRP90, LYS135, ARG142, MET172, HIS174 and 13 more
  • 6SCZ · Mycobacterium tuberculosis alanine racemase inhibited by dcs · OJQ A426 · binds VAL42, LYS44, TYR48, TRP90, LYS135, ARG142, MET172, HIS174 and 13 more

Residues it binds most

TYR 4, ARG 4, LYS 4, MET 4, ALA 4, ASN 4, CYS 4, GLY 4, HIS 4, ILE 4 (residue and the binding sites it lines).

Found with

  • L7N · (~{E})-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylidene-[(4~{R})-3-oxidanylidene-1,2-oxazolidin-4-yl]azanium
  • P4K · polyethylene glycol
  • CA · Calcium ion
  • CL · Chloride ion
  • EDO · 1,2-ethanediol
  • GOL · Glycerol
  • PEG · Di(hydroxyethyl)ether
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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