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Ligand · SM4

SM4 · (1R)-1-(2-thiophen-2-yl-acetylamino)-1-(3-(2-carboxyvinyl)-phenyl) methylboronic acid

SM4, (1R)-1-(2-thiophen-2-yl-acetylamino)-1-(3-(2-carboxyvinyl)-phenyl) methylboronic acid (C16 H16 B N O5 S, 345.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
SM4
Formula
C16 H16 B N O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

SM4 in 2 structures; the first of them:

  • 2RCX · AmpC Beta-lactamase in complex with (1R)-1-(2-Thiophen-2-yl-acetylamino)-1-(3-(2-carboxyvi… · SM4 A964 · binds GLY63, SER64, LYS67, LEU119, TYR150, ASN152, TYR221, ASN289 and 7 more
  • 2RCX · Ampc beta-lactamase in complex with (1R)-1-(2-thiophen-2-yl… · SM4 A964 · binds GLY63, SER64, LYS67, LEU119, TYR150, ASN152, TYR221, ASN289 and 7 more

Residues it binds most

ASN 4, GLY 4, LEU 4, LYS 4, TYR 4, THR 4, ALA 4, SER 4, GLN 2 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion

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