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Yorodumi- ChemComp-KSJ: [(1S,2R)-2-(2-hydroxybenzene-1-carbonyl)cyclopentyl]acetic acid -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: KSJ |
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Name | Name: [( |
-Chemical information
Composition | Formula: C14H16O4 / Number of atoms: 34 / Formula weight: 248.274 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: KSJ / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6NLZ | ||||
History |
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External links | UniChem / PubChem / ChemSpider / 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 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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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 2.0.6 | |
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-PDB entries
Showing all 3 items
PDB-6nlz:
Crystal structure of Mycobacterium tuberculosis dethiobiotin synthetase in complex with fragment degradation product B9D
PDB-6nmz:
Crystal structure of Mycobacterium tuberculosis dethiobiotin synthetase in complex with an intentionally produced fragment degradation product B9D
PDB-6nn0:
Crystal structure of Mycobacterium tuberculosis dethiobiotin synthetase in complex with 2'-deoxycytidine and fragment degradation product B9D