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Ligand · S1M

S1M · Methyl 2-[(2~{S})-1-ethanoyl-3-oxidanylidene-piperazin-2-yl]ethanoate

S1M, Methyl 2-[(2~{S})-1-ethanoyl-3-oxidanylidene-piperazin-2-yl]ethanoate (C9 H14 N2 O4, 214.2 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues…

Component
S1M
Formula
C9 H14 N2 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

S1M in 1 structure; the first of them:

  • 5R5G · Pandda analysis group deposition -- crystal structure of human NUDT22 in complex with… · S1M A401 · binds LEU55, PHE56, TYR87

Residues it binds most

LEU 1, PHE 1, TYR 1 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide

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