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Yorodumi- ChemComp-A68: N~2~-acetyl-N-[(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: A68 |
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Name | Name: |
-BIRD information
Type | Peptide-like / Inhibitor |
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Details |
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Downloads | Molecular definition / Chemical definition |
-Chemical information
Composition | Formula: C29H43N3O6S / Number of atoms: 82 / Formula weight: 561.733 / Formal charge: 0 | ||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: A68 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3SA9 / Subcomponent: ACE, ILE, FV0, 4OS | ||
History |
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External links | UniChem / ChemSpider / BindingDB / PubChem / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.2 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.2 | |
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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 1.7.2 | ( | |
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-PDB entries
Showing all 1 items
PDB-3sa9:
Crystal structure of Wild-type HIV-1 protease in complex With AF68