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Yorodumi- ChemComp-DRW: (2S,3R,4S)-2-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-3-methyl-4-({(3S... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: DRW |
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Name | Name: ( Synonyms: Doripenem(open form, pyrroline tautomer form 2, SP3 connection to Thio as S isomer) |
-Chemical information
Composition | Formula: C15H26N4O6S2 / Number of atoms: 53 / Formula weight: 422.52 / Formal charge: 0 | ||||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAD / Three letter code: DRW / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3IQA | ||||||||||
History |
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External links | UniChem / PubChem / ZINC / 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 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.7.6 | |
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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 1.7.6 | ( | |
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-PDB entries
Showing all 4 items
PDB-3iqa:
Crystal Structure of BlaC covalently bound with Doripenem
PDB-3isg:
Structure of the class D beta-lactamase OXA-1 in complex with doripenem
PDB-5dvp:
Crystal structure of Mycobacterium tuberculosis L,D-transpeptidase 2 with Doripenem adduct
PDB-7rpf:
X-ray crystal structure of OXA-24/40 in complex with doripenem