BioLiP

PDB

BioLiP

PDB CCD ID:

CUV

Number of entries in BioLiP:

Chemical formula:

Fe4 Ni S4

InChI:

InChI=1S/4Fe.Ni.4S

InChIKey:

QGLWBXDZIHZONR-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	[Ni].[Fe]S[Fe]1S[Fe]S[Fe]S1
OpenEye OEToolkits 2.0.6	S1[Fe][S]2[Fe]1S[Fe]2S[Fe][Ni]

Name:

Fe(4)-Ni(1)-S(4) cluster, oxidized;
C cluster, oxidized

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).