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Yorodumi- ChemComp-QLI: (5S,6S)-6-amino-5-[(1-carboxyethenyl)oxy]cyclohexa-1,3-diene-1-ca... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: QLI |
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Name | Name: ( Synonyms: 2-amino-2-deoxy-isochorismic acid |
-Chemical information
Composition | Formula: C10H11NO5 / Number of atoms: 27 / Formula weight: 225.198 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: QLI / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3R77 | ||||||
History |
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External links | UniChem / ChemSpider / Brenda / ChEBI / KEGG_Ligand / Nikkaji / PubChem / SureChEMBL / 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 1.7.0 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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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 1.7.0 | ( | |
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-PDB entries
Showing all 1 items
PDB-3r77:
Crystal structure of the D38A mutant of isochorismatase PhzD from Pseudomonas fluorescens 2-79 in complex with 2-amino-2-desoxyisochorismate ADIC