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Ligand · VD9

VD9 · 4-(propylsulfanyl)benzenesulfonamide

VD9, 4-(propylsulfanyl)benzenesulfonamide (C9 H13 N O2 S2, 231.3 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, the residues it binds most and the…

Component
VD9
Formula
C9 H13 N O2 S2
Class
ligand
Structures
2
PDB entries
2

Binding sites

VD9 in 2 structures; the first of them:

  • 4WW8 · Crystal structure of human carbonic anhydrase isozyme XII with… · VD9 A305 · binds GLN89, HIS91, HIS93, GLU104, HIS117, VAL119, ALA129, SER133 and 8 more
  • 5LLG · Crystal structure of human carbonic anhydrase isozyme II with 4… · VD9 A302 · binds GLN92, HIS94, HIS96, HIS119, VAL121, PHE131, VAL143, LEU198 and 4 more

Residues it binds most

HIS 6, THR 5, VAL 5, LEU 5, SER 4, TRP 6, GLN 5, ALA 4, GLU 4, PRO 3 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • BCN · Bicine
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol

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