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BioLiP

PDB CCD ID: RBU
Number of entries in BioLiP: 3
Chemical formula: C23 H20 N6 Ru
InChI: InChI=1S/2C10H8N2.C3H4N2.Ru/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2-5-3-4-1;/h2*1-8H;1-3H,(H,4,5);
InChIKey: LVAGRRXZENULKW-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385[Ru].[nH]1ccnc1.c2ccc(nc2)c3ccccn3.c4ccc(nc4)c5ccccn5
OpenEye OEToolkits 2.0.7c1ccnc(c1)C2=[N](C=CC=C2)[Ru]([N]3=CNC=C3)[N]4=C(C=CC=C4)c5ccccn5
Name:RUTHEMIUM BIS(2,2'-BIPYRIDINE)-2-IMIDAZOLE
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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