+Open data
-Basic information
Entry | Database: PDB chemical components / ID: SEM |
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Name | Name: |
-Chemical information
Composition | Formula: C10H13NO3 / Number of atoms: 27 / Formula weight: 195.215 / Formal charge: 0 | ||||||||||
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Others | Type: L-PEPTIDE LINKING / PDB classification: ATOMP / One letter code: S / Three letter code: SEM / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1THE / Parent comp.: SER | ||||||||||
History |
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External links | UniChem / Brenda / ChEBI / ChemicalBook / CompTox / GtoPharmacology / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.7.0 | ( | |
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-PDB entries
Showing all 1 items
PDB-6bi1:
Crystal Structure of Purine Nucleoside Phosphorylase Isoform 2 from Schistosoma mansoni in complex with (2R)-2-amino-3-(benzyloxy)propan-1-ol