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Ligand · CTJ

CTJ · 1-({(2R)-2-[(1R)-1-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(2-carboxypropan-2-yl)oxy]imino}acetyl]amino}-2-oxoethyl]-4-carboxy-3,6-dihydro-2H-1,3-thiazin-5-yl}methyl)pyridinium

CTJ, 1-({(2R)-2-[(1R)-1-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(2-carboxypropan-2-yl)oxy]imino}acetyl]amino}-2-oxoethyl]-4-carboxy-3,6-dihydro-2H-1,3-thiazin-5-yl}methyl)pyridinium (C22 H25 N6 O7 S2 +1, 549.6 g/mol), in the MolNFT…

Component
CTJ
Formula
C22 H25 N6 O7 S2 +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

CTJ in 2 structures; the first of them:

  • 6Q5F · OXA-48_P68A-CAZ. Evolutionary trade-offs of OXA-48 mediated ceftazidime-avibactam… · CTJ A301 · binds ALA69, SER70, ILE102, TRP105, SER118, VAL120, THR209, GLY210 and 5 more
  • 6Q5F · Oxa-48_P68A-caz. evolutionary trade-offs of oxa-48 mediated ceftazidime-avibactam… · CTJ A301 · binds ALA69, SER70, ILE102, TRP105, SER118, VAL120, THR209, GLY210 and 5 more

Residues it binds most

SER 4, ARG 4, THR 4, ALA 4, GLY 4, ILE 4, TRP 4, TYR 4, VAL 4, LEU 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • SO4 · Sulfate ion
  • PEG · Di(hydroxyethyl)ether
  • PGE · Triethylene glycol

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