+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 2LY |
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Name | Name: |
-Chemical information
Composition | Formula: C8H9NO3S / Number of atoms: 22 / Formula weight: 199.227 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 2LY / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4NRC | ||||
History |
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External links | UniChem / BindingDB / ChEMBL / CompTox / Nikkaji / 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 3 items
PDB-4nrc:
Crystal Structure of the bromodomain of human BAZ2B in complex with compound-3 N01186
PDB-5cqa:
Crystal structure of the bromodomain of bromodomain adjacent to zinc finger domain protein 2B (BAZ2B) in complex with N-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carboxamide (SGC - Diamond I04-1 fragment screening)
PDB-5s8i:
XChem group deposition -- Crystal Structure of the second bromodomain of pleckstrin homology domain interacting protein (PHIP) in complex with N01186d (space group C2)