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Yorodumi- ChemComp-0IU: (2S)-2-[(2-amino-1,3-thiazol-4-yl)methyl]-N~1~-[(1S,2R,3R)-1-(cyc... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 0IU |
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Name | Name: ( Synonyms: P2-P3 butanediamide renin inhibitor (1) |
-BIRD information
Type | Peptide-like / Inhibitor |
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Downloads | Molecular definition / Chemical definition |
-Chemical information
Composition | Formula: C34H53N5O5S / Number of atoms: 98 / Formula weight: 643.88 / Formal charge: 0 | ||||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 0IU / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1BIL / Model coordinates details: not provided | ||||||||||
History |
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External links | UniChem / PubChem / PubChem_TPharma / SureChEMBL / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.352 | |
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-SMILES CANONICAL
CACTVS 3.352 |
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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 1.6.1 | ( | |
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-PDB entries
Showing all 1 items
PDB-1bil:
CRYSTALLOGRAPHIC STUDIES ON THE BINDING MODES OF P2-P3 BUTANEDIAMIDE RENIN INHIBITORS