BioLiP

PDB

BioLiP

PDB CCD ID:

PT2

Number of entries in BioLiP:

Chemical formula:

C14 H14 N4 Pt

InChI:

InChI=1S/C12H8N2.C2H6N2.Pt/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;3-1-2-4;/h1-8H;3-4H,1-2H2;/q;-2;+4

InChIKey:

ZHOUVMJPJJXSDV-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	c1cc2ccc3ccc[n+]4c3c2[n+](c1)[Pt]45NCCN5
ACDLabs 10.04	c2cc[n+]4c3c1[n+](cccc1ccc23)[Pt]45NCCN5
CACTVS 3.341	C1CN[Pt]2(N1)[n+]3cccc4ccc5ccc[n+]2c5c34

Name:

[ethane-1,2-diaminato(2-)-kappa~2~N,N'](1,10-phenanthroline-kappa~2~N~1~,N~10~)platinum(2+)

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).