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Ligand · 3C4

3C4 · (3-chloro-4-hydroxyphenyl)acetic acid

3C4, (3-chloro-4-hydroxyphenyl)acetic acid (C8 H7 Cl O3, 186.6 g/mol), in the MolNFT structures on GenesisL1: bound in 10 records (5 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
3C4
Formula
C8 H7 Cl O3
Class
ligand
Structures
10
PDB entries
5

Binding sites

3C4 in 10 structures; the first of them:

  • 2H6B · Crystal structure of oxidized CprK in complex with o-chlorophenolacetic acid · 3C4 A302 · binds LEU63, LEU75, TYR76, LEU83, ILE84, GLY85, LYS86, THR90 and 7 more
  • 3E5U · OCPA complexed CprK (C200S) · 3C4 C504 · binds LEU63, LEU75, TYR76, LEU83, ILE84, GLY85, LYS86, THR90 and 7 more
  • 3E5X · OCPA complexed CprK · 3C4 A501 · binds LEU63, LEU75, TYR76, LEU83, ILE84, GLY85, LYS86, THR90 and 7 more
  • 3E6B · OCPA complexed CprK (C200S) · 3C4 A301 · binds LEU63, LEU75, TYR76, LEU83, ILE84, GLY85, LYS86, THR90 and 7 more
  • 3E6C · CprK OCPA DNA Complex · 3C4 C604 · binds LEU63, TYR76, LEU83, ILE84, GLY85, LYS86, THR90, ASN92 and 3 more
  • 2H6B · Crystal structure of oxidized cprk in complex with O- chlorophenolacetic acid · 3C4 A302 · binds LEU63, LEU75, TYR76, LEU83, ILE84, GLY85, LYS86, THR90 and 7 more
  • 3E5U · Ocpa complexed cprk (C200S) · 3C4 C504 · binds LEU63, LEU75, TYR76, LEU83, ILE84, GLY85, LYS86, THR90 and 7 more
  • 3E5X · Ocpa complexed cprk · 3C4 A501 · binds LEU63, LEU75, TYR76, LEU83, ILE84, GLY85, LYS86, THR90 and 7 more
  • 3E6B · Ocpa complexed cprk (C200S) · 3C4 A301 · binds LEU63, LEU75, TYR76, LEU83, ILE84, GLY85, LYS86, THR90 and 7 more
  • 3E6C · Cprk ocpa DNA complex · 3C4 C604 · binds LEU63, TYR76, LEU83, ILE84, GLY85, LYS86, THR90, ASN92 and 3 more

Residues it binds most

LEU 26, ILE 26, LYS 26, TYR 26, THR 30, ALA 28, ASN 26, GLY 26, VAL 24, ARG 4 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • PO4 · Phosphate ion
  • SO4 · Sulfate ion

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