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- ChemComp-SA2: (3R)-4-[(4-CARBOXYBUTANOYL)OXY]-N-[(1E)-3-OXOPROP-1-EN-1-YL]-3-SU... -
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Open data
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Basic information
Entry | ![]() |
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Name | Name: ( Synonyms: 4-AZA-5-CARBOXY-6-SULFENATE-6-METHYL-8-OXA-9-OXO-TRIS-2-TRANS-DECENEDIOIC ACID |
-Chemical information
Composition | |||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: SA2 / Model coordinates PDB-ID: 2H5S | ||||||
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 5 items
![](data/pdb/img/2h5s.jpg)
PDB-2h5s:
SA2-13 penam sulfone complexed to wt SHV-1 beta-lactamase
![](data/pdb/img/3opp.jpg)
PDB-3opp:
ESBL R164S mutant of SHV-1 beta-lactamase complexed with SA2-13
![](data/pdb/img/3opr.jpg)
PDB-3opr:
ESBL R164H mutant of SHV-1 beta-lactamase complexed to SA2-13
![](data/pdb/img/3v50.jpg)
PDB-3v50:
Complex of SHV S130G mutant beta-lactamase complexed to SA2-13
![](data/pdb/img/4mbk.jpg)
PDB-4mbk:
Crystal structure of K234R inhibitor-resistant variant of SHV beta-lactamase in complex with SA2-13