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Ligand · IJC

IJC · 2-[(4-chloranyl-6-methoxy-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid

IJC, 2-[(4-chloranyl-6-methoxy-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid (C13 H11 Cl N4 O6 S, 386.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å…

Component
IJC
Formula
C13 H11 Cl N4 O6 S
Class
ligand
Structures
2
PDB entries
2

Binding sites

IJC in 2 structures; the first of them:

  • 7YD2 · SulE_P44R_S209A · IJC A405 · binds GLY77, GLY78, ASN141, SER142, GLY146, ALA147, ARG150, ALA209 and 11 more
  • 8GOL · crystal structure of SulE · IJC A401 · binds GLY77, GLY78, ARG150, SER209, ALA210, ALA234, PHE257, PRO258 and 6 more

Residues it binds most

ALA 6, GLY 6, PHE 6, TRP 6, ARG 6, HIS 6, SER 6, ASN 2, ILE 4, PRO 4 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol
  • CIE · 2-[[[[(4-chloro-6-methoxy-2-pyrimidinyl) amino]carbonyl]amino]sulfonyl]benzoic acid ethyl ester
  • CA · Calcium ion
  • SO4 · Sulfate ion

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