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Ligand · 0OC

0OC · N,N-dimethylthiophene-3-sulfonamide

0OC, N,N-dimethylthiophene-3-sulfonamide (C6 H9 N O2 S2, 191.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands…

Component
0OC
Formula
C6 H9 N O2 S2
Class
ligand
Structures
4
PDB entries
2

Binding sites

0OC in 4 structures; the first of them:

  • 4EFK · Pantothenate synthetase in complex with N,N-DIMETHYLTHIOPHENE-3-SULFONAMIDE · 0OC A401 · binds PRO38, THR39, MET40, SER65, PHE67, VAL68, ASN69, VAL139 and 5 more
  • 4G5Y · Crystal Structure of Mycobacterium tuberculosis Pantothenate synthetase in a ternary… · 0OC A403 · binds PRO38, THR39, MET40, SER65, PHE67, VAL68, ASN69, GLN72 and 6 more
  • 4EFK · Pantothenate synthetase in complex with N,N-dimethylthiophene-3- sulfonamide · 0OC A401 · binds PRO38, THR39, MET40, SER65, PHE67, VAL68, ASN69, VAL139 and 5 more
  • 4G5Y · Crystal structure of mycobacterium tuberculosis pantothenate synthetase in a ternary… · 0OC A403 · binds PRO38, THR39, MET40, SER65, PHE67, VAL68, ASN69, GLN72 and 6 more

Residues it binds most

VAL 10, PHE 8, GLN 10, PRO 12, ALA 2, MET 10, ASN 8, LEU 8, SER 8, THR 8 (residue and the binding sites it lines).

Found with

  • EOH · Ethanol
  • GOL · Glycerol
  • ATP · Adenosine-5'-triphosphate
  • MG · Magnesium ion
  • SO4 · Sulfate ion
  • IMD · Imidazole

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