+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 4OA | ||
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Name | Name: ( Synonyms: Lithocholic acid Comment | detergent*YM | |
-Chemical information
Composition | Formula: C24H40O3 / Number of atoms: 67 / Formula weight: 376.573 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 4OA / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3F3Y | ||||||
History |
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External links | UniChem / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / GtoPharmacology / HMDB / KEGG_Ligand / LipidMaps / Metabolights / NMRShiftDB / 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 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 4 items
PDB-3f3y:
Crystal structure of human cytosolic sulfotransferase SULT2A1 in complex with PAP and lithocholic acid
PDB-3w5p:
Crystal structure of complexes of vitamin D receptor ligand binding domain with lithocholic acid derivatives
PDB-4q0a:
Vitamin D Receptor complex with lithocholic acid
PDB-6e48:
Crystal Structure of the Murine Norovirus VP1 P domain in complex with the CD300lf Receptor and Lithocholic Acid