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Ligand · CMS

CMS · Carbamoyl sarcosine

CMS, Carbamoyl sarcosine (C4 H8 N2 O3, 132.1 g/mol), in the MolNFT structures on GenesisL1: bound in 4 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
CMS
Formula
C4 H8 N2 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

CMS in 4 structures; the first of them:

  • 1CHM · Enzymatic mechanism of creatine amidinohydrolase as deduced from crystal structures · CMS A404 · binds ALA231, HIS232, TYR258, GLU262, PHE320, HIS324, ARG335, GLU358 and 4 more
  • 3Q9N · In silico and in vitro co-evolution of a high affinity complementary protein-protein… · CMS A1071 · binds GLU135
  • 1CHM · Enzymatic mechanism of creatine amidinohydrolase as deduced from crystal structures · CMS A404 · binds ALA231, HIS232, TYR258, GLU262, PHE320, HIS324, ARG335, GLU358 and 4 more
  • 3Q9N · In silico and in vitro co-evolution of a high affinity complementary protein-protein… · CMS A1071 · binds GLU135

Residues it binds most

HIS 4, ARG 4, GLU 6, PHE 4, ALA 4, ILE 4, TYR 4 (residue and the binding sites it lines).

Found with

  • COA · Coenzyme A

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