BioLiP

PDB

BioLiP

PDB CCD ID:

T9U

Number of entries in BioLiP:

Chemical formula:

C5 H10 N2 O2 Ru

InChI:

InChI=1S/C5H9N2.H2O.O.Ru/c1-6-3-4-7(2)5-6;;;/h3-5H,1-2H3;1H2;;/q;;;+1/p-1

InChIKey:

DEXKHQIKGXONQU-UHFFFAOYSA-M

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	CN1C=CN(C1[Ru](=O)O)C
CACTVS 3.385	CN1C=CN(C)C1[Ru](O)=O

Name:

(1,3-dimethyl-2~{H}-imidazol-2-yl)-oxidanyl-oxidanylidene-ruthenium

Reference:

Chengxin Zhang, Xi Zhang, Lydia 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).