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- ChemComp-1C6: 6-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl... -
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Open data
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Basic information
Entry | ![]() | ||
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Name | Name: Synonyms: omeprazole; prilosec Comment | medication*YM | |
-Chemical information
Composition | |||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 1C6 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4KEW | ||||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.370 | 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 5 items
![](data/pdb/img/4kew.jpg)
PDB-4kew:
structure of the A82F BM3 heme domain in complex with omeprazole
![](data/pdb/img/4key.jpg)
PDB-4key:
Structure of P450 BM3 A82F F87V in complex with omeprazole
![](data/pdb/img/4o4p.jpg)
PDB-4o4p:
Structure of P450 BM3 A82F F87V in complex with S-omeprazol
![](data/pdb/img/8dme.jpg)
PDB-8dme:
CYP102A1 in Open Conformation
![](data/pdb/img/8dmg.jpg)
PDB-8dmg:
CYP102A1 in Closed Conformation