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Ligand · SHF

SHF · Laevulinic acid

SHF, Laevulinic acid (C5 H8 O3, 116.1 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
SHF
Formula
C5 H8 O3
Class
ligand
Structures
3
PDB entries
2

Binding sites

SHF in 3 structures; the first of them:

  • 6HJG · Trypanosoma cruzi proline racemase in complex with inhibitor OxoPA · SHF A500 · binds CYS130, GLY131, HIS132, ASP296, CYS300, GLY301, THR302
  • 6HJF · Trypanosoma cruzi proline racemase in complex with inhibitor broxopa · SHF A500 · binds PHE102, LEU127, CYS130, GLY131, HIS132, PHE290, ASP296, CYS300 and 2 more
  • 6HJG · Trypanosoma cruzi proline racemase in complex with inhibitor oxopa · SHF A500 · binds CYS130, GLY131, HIS132, ASP296, CYS300, GLY301, THR302

Residues it binds most

CYS 6, GLY 6, ASP 6, HIS 6, THR 6, PHE 2, LEU 2, MET 1 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion

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