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Yorodumi- ChemComp-4B5: N-{(2R,4S,5S)-2-benzyl-5-[(tert-butoxycarbonyl)amino]-4-hydroxy-6... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 4B5 |
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Name | Name: |
-BIRD information
Type | Peptide-like / Inhibitor |
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Downloads | Molecular definition / Chemical definition |
-Chemical information
Composition | Formula: C39H52N4O6 / Number of atoms: 101 / Formula weight: 672.853 / Formal charge: 0 | ||||
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Others | Type: peptide-like / PDB classification: HETAIN / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4Y6K / Subcomponent: BOC, PJJ, LEU, NFA | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / CompTox / Nikkaji / PubChem / PubChem_TPharma / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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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 1.9.2 | |
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-PDB entries
Showing all 1 items
PDB-4y6k:
Complex structure of presenilin homologue PSH bound to an inhibitor