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Ligand · VFJ

VFJ · N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)butanamide

VFJ, N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)butanamide (C6 H10 N4 O3 S2, 250.3 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…

Component
VFJ
Formula
C6 H10 N4 O3 S2
Class
ligand
Structures
4
PDB entries
2

Binding sites

VFJ in 4 structures; the first of them:

  • 7JNV · Carbonic Anhydrase II Complexed with N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)butyramide · VFJ A304 · binds ILE91, GLN92, HIS94, HIS96, GLU106, HIS119, VAL121, PHE131 and 6 more
  • 7JO1 · Carbonic Anhydrase IX Mimic Complexed with N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)butyramide · VFJ A302 · binds LEU91, GLN92, HIS94, HIS96, GLU106, HIS119, VAL121, VAL131 and 8 more
  • 7JNV · Carbonic anhydrase II complexed with N-(5-sulfamoyl-1,3,4-thiadiazol- 2-YL)BUTYRAMIDE · VFJ A304 · binds ILE91, GLN92, HIS94, HIS96, GLU106, HIS119, VAL121, PHE131 and 6 more
  • 7JO1 · Carbonic anhydrase IX mimic complexed with N-(5-sulfamoyl-1,3,4… · VFJ A302 · binds LEU91, GLN92, HIS94, HIS96, GLU106, HIS119, VAL121, VAL131 and 8 more

Residues it binds most

HIS 6, VAL 6, GLN 6, LEU 4, THR 4, TRP 6, GLU 6, PHE 6, PRO 2, ILE 4 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • DMS · Dimethyl sulfoxide
  • GOL · Glycerol

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