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Ligand · TCL

TCL · Triclosan

TCL, Triclosan (C12 H7 Cl3 O2, 289.5 g/mol), in the MolNFT structures on GenesisL1: bound in 5 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
TCL
Formula
C12 H7 Cl3 O2
Class
ligand
Structures
5
PDB entries
3

Binding sites

TCL in 5 structures; the first of them:

  • 6AH9 · Crystal structure of enoyl-ACP reductase from Acinetobacter baumannii in complex with NAD… · TCL A302 · binds GLY95, PHE96, ALA97, LEU102, TYR149, TYR159, LYS166, ALA199 and 3 more
  • 7FCM · Crystal structure of Moraxella catarrhalis enoyl-ACP-reductase (FabI) in complex with NAD… · TCL A302 · binds GLY97, PHE98, ALA99, LEU104, TYR151, TYR161, MET164, LYS168 and 6 more
  • 5YCS · X-ray structure of enoyl-acyl carrier protein reductase from bacillus anthracis with… · TCL A502 · binds ALA95, ALA97, LEU102, TYR147, TYR157, MET160, LYS164, SER197 and 2 more
  • 6AH9 · Crystal structure of enoyl-acp reductase from acinetobacter baumannii in complex with NAD… · TCL A302 · binds GLY95, PHE96, ALA97, LEU102, TYR149, TYR159, LYS166, ALA199 and 3 more
  • 7FCM · Crystal structure of moraxella catarrhalis enoyl-acp-reductase (fabi) in complex with NAD… · TCL A302 · binds GLY97, PHE98, ALA99, LEU104, TYR151, TYR161, MET164, LYS168 and 5 more

Residues it binds most

ALA 10, TYR 10, PHE 10, MET 10, LEU 10, LYS 8, GLY 6, ILE 4, SER 4, PRO 2 (residue and the binding sites it lines).

Found with

  • NAD · Nicotinamide-adenine-dinucleotide
  • CA · Calcium ion
  • SO4 · Sulfate ion

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