+Open data
-Basic information
Entry | Database: PDB chemical components / ID: RY2 |
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Name | Name: ( Synonyms: [3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]boronic acid; 3-(1H-Tetrazol-5-yl)phenylboronic Acid; 3-(2H-Tetrazol-5-yl)-phenyl-boronic acid; 3-(TETRAZOL-5-YL)PHENYLBORONIC ACID; Boronic acid,B-[3- ...Synonyms: [3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]boronic acid; 3-(1H-Tetrazol-5-yl)phenylboronic Acid; 3-(2H-Tetrazol-5-yl)-phenyl-boronic acid; 3-(TETRAZOL-5-YL)PHENYLBORONIC ACID; Boronic acid,B-[3-(2H-tetrazol-5-yl)phenyl]- |
-Chemical information
Composition | Formula: C7H7BN4O2 / Number of atoms: 21 / Formula weight: 189.967 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: RY2 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7ATM | ||||
History |
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External links | UniChem / ChEMBL / ChemicalBook / CompTox / Nikkaji / PubChem / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-PDB entries
Showing all 1 items
PDB-7atm:
Structure of P. aeruginosa PBP3 in complex with a phenyl boronic acid (Compound 1)