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BioLiP

PDB CCD ID: 5LN
Number of entries in BioLiP: 1
Chemical formula: C2 H8 Cl O4 Ru
InChI: InChI=1S/2CH3O.ClH.2H2O.Ru/c2*1-2;;;;/h2*2H,1H2;1H;2*1H2;/q;;;;;+3/p-3
InChIKey: KMSYBSCWEKUGEO-UHFFFAOYSA-K
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.4C(O)[Ru](CO)(O)(O)Cl
CACTVS 3.385OC[Ru](O)(O)(Cl)CO
Name:chloranyl-bis(hydroxymethyl)-bis(oxidanyl)ruthenium;
Ru(CO)2Cl(OH2)2
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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