BioLiP

PDB

BioLiP

PDB CCD ID:

MSK

Number of entries in BioLiP:

Chemical formula:

Fe4 S4

InChI:

InChI=1S/4Fe.4S/q;;;;;;2*+1

InChIKey:

BEJQIPSIAWWLMO-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	S1[Fe]2S[Fe]3[S+]2[Fe]1[S+]3[Fe]
CACTVS 3.385	[Fe][S+]1[Fe]2S[Fe]3S[Fe]1[S+]23

Name:

Broken Fe4S4 cluster

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).