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Ligand · E08

E08 · Trihydroxy-[(1S)-1-[(2-propan-2-ylphenyl)carbonylamino]ethyl]boron

E08, Trihydroxy-[(1S)-1-[(2-propan-2-ylphenyl)carbonylamino]ethyl]boron (C12 H19 B N O4 -1, 252.1 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…

Component
E08
Formula
C12 H19 B N O4 -1
Class
ligand
Structures
2
PDB entries
1

Binding sites

E08 in 2 structures; the first of them:

  • 2Y2M · Penicillin-binding protein 1B (pbp-1B) in complex with an alkyl boronate (E08) · E08 A1000 · binds ALA459, SER460, LYS463, MET497, TYR498, ALA499, SER516, ASN518 and 6 more
  • 2Y2M · Penicillin-binding protein 1B (pbp-1B) in complex with an alkyl boronate (E08) · E08 A1000 · binds ALA459, SER460, LYS463, MET497, TYR498, ALA499, SER516, ASN518 and 6 more

Residues it binds most

ALA 2, GLY 2, MET 2, SER 2, THR 2, ASN 2, ASP 2, LYS 2, TYR 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • CL · Chloride ion

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