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Ligand · 5XR

5XR · 2-hydroxy-N-[(1S)-1-hydroxy-3-oxopropyl]-L-aspartic acid

5XR, 2-hydroxy-N-[(1S)-1-hydroxy-3-oxopropyl]-L-aspartic acid (C7 H11 N O7, 221.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
5XR
Formula
C7 H11 N O7
Class
ligand
Structures
2
PDB entries
2

Binding sites

5XR in 2 structures; the first of them:

  • 6OR8 · An unexpected intermediate in the reaction catalyzed by quinolinate synthase · 5XR A402 · binds HIS21, TYR23, ASP37, SER38, MET61, TYR109, ASN111, SER126 and 5 more
  • 6ORA · An unexpected intermediate in the reaction catalyzed by quinolinate synthase · 5XR B403 · binds HIS21, TYR23, ASP37, SER38, LEU39, MET61, TYR109, ASN111 and 7 more

Residues it binds most

SER 2, HIS 2, TYR 2, THR 2, ASN 2, ASP 2, MET 2, ALA 1, GLN 1, GLU 1 (residue and the binding sites it lines).

Found with

  • SF4 · Iron/sulfur cluster
  • 5XW · (2~{Z})-2-(1-oxidanyl-3-oxidanylidene-propyl) iminobutanedioic acid
  • CL · Chloride ion
  • PO4 · Phosphate ion
  • ACT · Acetate ion

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