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Open data
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Basic information
Entry | ![]() |
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Name | Name: Synonyms: 2-{[(1S)-1-HYDROXYETHYL]THIO}-N,N,N-TRIMETHYLETHANAMINIUM |
-Chemical information
Composition | |||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: AT3 / Model coordinates PDB-ID: 2C4H | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.5.0 | |
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-PDB entries
Showing all 6 items
![](data/pdb/img/2c4h.jpg)
PDB-2c4h:
Torpedo californica acetylcholinesterase in complex with 500mM acetylthiocholine
![](data/pdb/img/2c58.jpg)
PDB-2c58:
Torpedo californica acetylcholinesterase in complex with 20mM acetylthiocholine
![](data/pdb/img/2ha5.jpg)
PDB-2ha5:
Crystal structure of mutant S203A of acetylcholinesterase complexed with acetylthiocholine
![](data/pdb/img/6uqy.jpg)
PDB-6uqy:
Crystal structure of ChoE H288N mutant in complex with acetylthiocholine
![](data/pdb/img/6ur1.jpg)
PDB-6ur1:
Crystal structure of ChoE S38A mutant in complex with acetate and acetylthiocholine
![](data/pdb/img/8d8y.jpg)
PDB-8d8y:
Crystal structure of ChoE N147A mutant in complex with acetylthiocholine