BioLiP

PDB

BioLiP

PDB CCD ID:

FC6

Number of entries in BioLiP:

Chemical formula:

C6 Fe N6

InChI:

InChI=1S/6CN.Fe/c6*1-2;

InChIKey:

HCMVSLMENOCDCK-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C(#N)[Fe](C#N)(C#N)(C#N)(C#N)C#N
ACDLabs 10.04 CACTVS 3.341	N#C[Fe](C#N)(C#N)(C#N)(C#N)C#N

Name:

HEXACYANOFERRATE(3-);
FERRI(III)HEXACYANIDE

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).