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Ligand · SXM

SXM · 3-{[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}-3-oxopropanoic acid

SXM, 3-{[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}-3-oxopropanoic acid (C14 H25 N2 O10 P S, 444.4 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every…

Component
SXM
Formula
C14 H25 N2 O10 P S
Class
ligand
Structures
6
PDB entries
3

Binding sites

SXM in 6 structures; the first of them:

  • 2KG8 · NMR Solution Structures of malonyl ACP from the actinorhodin polyketide synthase in… · SXM A87 · binds SER42, LEU43, MET46, ASP62, GLY66
  • 2X2B · Crystal structure of malonyl-ACP (acyl carrier protein) from Bacillus subtilis · SXM A101 · binds LYS30, ASP36, SER37
  • 3NY7 · STAS domain of YchM bound to ACP · SXM B79 · binds VAL517, LEU522, MET525, ALA526, GLY529, ILE530, GLN531, PRO532 and 7 more
  • 2KG8 · NMR solution structures of malonyl acp from the actinorhodin polyketide synthase in… · SXM A87 · binds SER42, LEU43, MET46, ASP62, GLY66
  • 2X2B · Crystal structure of malonyl-acp (acyl carrier protein) from bacillus subtilis · SXM A101 · binds LYS30, ASP36, SER37
  • 3NY7 · Stas domain of ychm bound to acp · SXM B79 · binds VAL517, LEU522, MET525, ALA526, GLY529, ILE530, GLN531, PRO532 and 7 more

Residues it binds most

ASP 6, LEU 4, SER 6, GLY 4, MET 4, PHE 2, PRO 2, ALA 2, GLN 2, GLU 2 (residue and the binding sites it lines).

Found with

  • PT · Platinum (II) ion
  • GOL · Glycerol

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