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Ligand · J2C

J2C · 8-(2-chloroacetyl)-4-(furan-2-ylmethyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one

J2C, 8-(2-chloroacetyl)-4-(furan-2-ylmethyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one (C14 H17 Cl N2 O3 S, 328.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
J2C
Formula
C14 H17 Cl N2 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

J2C in 2 structures; the first of them:

  • 7EFJ · Crystal Structure Analysis of human PIN1 · J2C A201 · binds HIS59, LEU61, CYS113, SER114, GLN129, MET130, GLN131, PHE134 and 2 more
  • 7EFJ · Crystal structure analysis of human PIN1 · J2C A201 · binds HIS59, LEU61, CYS113, SER114, GLN129, MET130, GLN131, PHE134 and 2 more

Residues it binds most

GLN 2, HIS 2, SER 2, CYS 2, LEU 2, MET 2, PHE 2 (residue and the binding sites it lines).

Found with

  • PE8 · 3,6,9,12,15,18,21-heptaoxatricosane-1,23-diol

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