+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 46P |
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Name | Name: |
-Chemical information
Composition | Formula: C8H10N4S / Number of atoms: 23 / Formula weight: 194.257 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 46P / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4Y3X | ||||
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 1.9.2 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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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 1.9.2 | |
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-PDB entries
Showing all 4 items
PDB-4y3x:
Endothiapepsin in complex with fragment 171
PDB-5mb5:
Cocktail experiment C: fragments 103 and 171 in complex with Endothiapepsin
PDB-5n3a:
cAMP-dependent Protein Kinase A from Cricetulus griseus in complex with fragment like molecule 4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-amine
PDB-5rp6:
PanDDA analysis group deposition -- Proteinase K changed state model for fragment Frag Xtal Screen C2a