[English] 日本語
Yorodumi- ChemComp-5CI: 8-bromo-5'-{[3-carboxy-2-(carboxymethyl)-2-hydroxypropanoyl]amino... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 5CI |
---|---|
Name | Name: |
-Chemical information
Composition | Formula: C16H19BrN6O9 / Number of atoms: 51 / Formula weight: 519.261 / Formal charge: 0 | ||
---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 5CI / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3V8N | ||
History |
| ||
External links | UniChem / ChemSpider / PubChem / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.7.6 | |
---|
-PDB entries
Showing all 1 items
PDB-3v8n:
Crystal structure of NAD kinase 1 from Listeria monocytogenes in complex with 8-bromo-5'-amino-5'-deoxyadenosine, reacted with a citrate molecule in N site