+Open data
-Basic information
Entry | Database: PDB chemical components / ID: CE2 |
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Name | Name: Synonyms: (S)-ATPA; (S)-2-AMINO-3-(3-HYDROXY-5-TERT-BUTYL-ISOXAZOL-4-YL)PROPIONIC ACID |
-Chemical information
Composition | Formula: C10H15N2O4 / Number of atoms: 31 / Formula weight: 227.237 / Formal charge: -1 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: CE2 / Model coordinates PDB-ID: 1NNK | ||||||
History |
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External links | UniChem / ChemSpider / DrugBank / PubChem / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | [CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | (OpenEye OEToolkits 1.5.0 | ( | |
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-PDB entries
Showing all 2 items
PDB-1nnk:
X-ray structure of the GluR2 ligand-binding core (S1S2J) in complex with (S)-ATPA at 1.85 A resolution. Crystallization with zinc ions.
PDB-1nnp:
X-ray structure of the GluR2 ligand-binding core (S1S2J) in complex with (S)-ATPA at 1.9 A resolution. Crystallization without zinc ions.