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Ligand · ITC

ITC · Iso-7-chlortetracycline

ITC, Iso-7-chlortetracycline (C22 H23 Cl N2 O8, 478.9 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
ITC
Formula
C22 H23 Cl N2 O8
Class
ligand
Structures
6
PDB entries
3

Binding sites

ITC in 6 structures; the first of them:

  • 2X9D · Tet repressor (class D) in complex with iso-7-chlortetracycline · ITC A1209 · binds LEU60, HIS64, SER67, ASN82, PHE86, HIS100, ARG104, PRO105 and 10 more
  • 4B1R · Tetracycline repressor class D mutant H100A in complex with iso-7- Chlortetracycline · ITC A1209 · binds LEU60, HIS64, SER67, ASN82, PHE86, ARG104, PRO105, GLN109 and 8 more
  • 4V2G · Tetracycline repressor TetR(D) bound to chlortetracycline and iso- chlortetracycline · ITC A222 · binds LEU60, HIS64, SER67, ASN82, PHE86, HIS100, ARG104, PRO105 and 12 more
  • 2X9D · Tet repressor (class D) in complex with iso-7-chlortetracycline · ITC A1209 · binds LEU60, HIS64, SER67, ASN82, PHE86, HIS100, ARG104, PRO105 and 10 more
  • 4B1R · Tetracycline repressor class D mutant H100A in complex with iso-7- chlortetracycline · ITC A1209 · binds LEU60, HIS64, SER67, ASN82, PHE86, ARG104, PRO105, GLN109 and 8 more
  • 4V2G · Tetracycline repressor TETR(D) bound to chlortetracycline and iso-chlortetracycline · ITC A222 · binds LEU60, HIS64, SER67, ASN82, PHE86, HIS100, ARG104, PRO105 and 12 more

Residues it binds most

SER 6, HIS 6, LEU 6, GLN 6, VAL 6, ARG 6, ASN 6, ILE 6, PHE 6, PRO 6 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • CTC · 7-chlorotetracycline
  • MG · Magnesium ion

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