BioLiP

PDB

BioLiP

PDB CCD ID:

YWV

Number of entries in BioLiP:

Chemical formula:

C14 H14 N2 O2 Ru2

InChI:

InChI=1S/C13H12N2.CH2O2.2Ru/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;2-1-3;;/h1-10H,11H2;1H2;;/q2*-2;2*+2

InChIKey:

CVNAOZKWKIHKRL-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccc(cc1)N2CN([Ru]3[Ru]2OCO3)c4ccccc4
CACTVS 3.385	C1O[Ru]N(CN([Ru]O1)c2ccccc2)c3ccccc3

Name:

[Ru2(DPhF)(Formate)]

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).