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Ligand · 27A

27A · (Z)-2-[2-(4-methylpiperazin-1-yl)benzyl]diazenecarbothioamide

27A, (Z)-2-[2-(4-methylpiperazin-1-yl)benzyl]diazenecarbothioamide (C13 H19 N5 S, 277.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
27A
Formula
C13 H19 N5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

27A in 2 structures; the first of them:

  • 3GK2 · X-ray structure of bovine SBi279,Ca(2+)-S100B · 27A A94 · binds HIS42, PHE43, GLU45, ILE80, ALA83, PHE87
  • 3GK2 · X-ray structure of bovine SBI279,CA(2+)-S100B · 27A A94 · binds HIS42, PHE43, GLU45, ILE80, ALA83, PHE87

Residues it binds most

PHE 2, ALA 2, GLU 2, HIS 2, ILE 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • CAC · Cacodylate ion

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