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Ligand · I27

I27 · methyl (Z)-4-[1-[(3-chlorophenyl)methyl]-4-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-oxidanyl-4-oxidanylidene-but-2-enoate

I27, methyl (Z)-4-[1-[(3-chlorophenyl)methyl]-4-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-oxidanyl-4-oxidanylidene-but-2-enoate (C24 H25 Cl2 N O4, 462.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
I27
Formula
C24 H25 Cl2 N O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

I27 in 2 structures; the first of them:

  • 7EX8 · Crystal structure of Ebinur Lake virus cap snatching endonuclease in complex with… · I27 A203 · binds LEU30, GLU31, HIS34, ASN52, ASP79, ASP92, TYR93, LYS94
  • 7EX8 · Crystal structure of ebinur lake virus cap snatching endonuclease in complex with… · I27 A203 · binds LEU30, GLU31, HIS34, ASN52, ASP79, ASP92, TYR93, LYS94

Residues it binds most

ASP 2, ASN 2, GLU 2, HIS 2, LEU 2, LYS 2, TYR 2 (residue and the binding sites it lines).

Found with

  • MN · Manganese (II) ion
  • CL · Chloride ion

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