Ligand · SME
SME · Methionine sulfoxide
SME, Methionine sulfoxide (C5 H11 N O3 S, 165.2 g/mol), in the MolNFT structures on GenesisL1: bound in 10 records (5 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.
- Component
- SME
- Formula
- C5 H11 N O3 S
- Class
- ligand
- Structures
- 10
- PDB entries
- 5
Binding sites
SME in 10 structures; the first of them:
- 3KO6 · Crystal structure of yeast free methionine-R-sulfoxide reductase Ykg9 in complex with the… · SME A181 · binds TRP66, TYR70, ALA90, ILE94, LYS98, GLY99, VAL100, CYS101 and 6 more
- 3KSG · structure of fRMsr of Staphylococcus aureus (complex with substrate) · SME A6888 · binds TRP46, TYR50, ALA67, ILE71, LYS75, GLY76, VAL77, CYS78 and 5 more
- 3MMH · X-ray structure of free methionine-R-sulfoxide reductase from neisseria meningitidis in… · SME A168 · binds TRP51, TYR55, ALA74, ILE78, ARG82, GLY83, VAL84, CYS85 and 6 more
- 3RFB · Structure of fRMsr · SME A6888 · binds PHE47, TYR51, SER68, ILE72, LYS76, GLY77, VAL78, CYS79 and 8 more
- 4MN7 · Structural and biochemical analysis of type II free methionine-R-sulfoxide reductase from… · SME B500 · binds TRP27, TYR31, THR48, HIS50, ILE53, ASP57, GLY58, LEU59 and 8 more
- 3KO6 · Crystal structure of yeast free methionine-R-sulfoxide reductase YKG9 in complex with the… · SME A181 · binds TRP66, TYR70, ALA90, ILE94, LYS98, GLY99, VAL100, CYS101 and 6 more
- 3KSG · Structure of frmsr of staphylococcus aureus (complex with substrate) · SME A6888 · binds TRP46, TYR50, ALA67, ILE71, LYS75, GLY76, VAL77, CYS78 and 5 more
- 3MMH · X-ray structure of free methionine-R-sulfoxide reductase from neisseria meningitidis in… · SME A168 · binds TRP51, TYR55, ALA74, ILE78, ARG82, GLY83, VAL84, CYS85 and 6 more
- 3RFB · Structure of frmsr · SME A6888 · binds PHE47, TYR51, SER68, ILE72, LYS76, GLY77, VAL78, CYS79 and 8 more
- 4MN7 · Structural and biochemical analysis of type II free methionine-R- sulfoxide reductase… · SME B500 · binds TRP27, TYR31, THR48, HIS50, ILE53, ASP57, GLY58, LEU59 and 8 more
Residues it binds most
ASP 18, CYS 18, ILE 18, GLY 18, TYR 18, GLU 18, VAL 16, ALA 14, TRP 14, LYS 10 (residue and the binding sites it lines).
Found with
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