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Yorodumi- ChemComp-0ZX: N-(tert-butoxycarbonyl)-L-alanyl-N-[(1S)-5-amino-1-(diethoxyboran... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 0ZX |
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Name | Name: |
-BIRD information
Type | Peptide-like / Inhibitor |
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Downloads | Molecular definition / Chemical definition / Family definition |
Synonyms |
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Annotation |
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External info | |
Family | Tripeptide boronates esterified at the boron by alcohols T-BUTOXY-ALA-VAL-BORO-LYS 1,3-PROPANEDIOL MONOESTER / T-BUTOXY-ALA-VAL-BORO-LYS ETHYL ESTER / T-BUTOXY-ALA-VAL-BORO-LYS METHYL ESTER |
-Chemical information
Composition | Formula: C22H45BN4O6 / Number of atoms: 78 / Formula weight: 472.427 / Formal charge: 0 | ||||
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Others | Type: peptide-like / PDB classification: HETAIN / Three letter code: 0ZX / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1BTX / Model coordinates details: not provided / Subcomponent: BOC, ALA, VAL, 0AY | ||||
History |
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External links | UniChem / ChemSpider / PubChem / 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-1btx:
Episelection: Novel Ki ~Nanomolar Inhibitors of Serine Proteases Selected by Binding or Chemistry on an Enzyme Surface