BioLiP

PDB

BioLiP

PDB CCD ID:

CZL

Number of entries in BioLiP:

Chemical formula:

Fe8 H6 S9

InChI:

InChI=1S/8Fe.6HS.3S/h;;;;;;;;6*1H;;;

InChIKey:

FRFZBLMXGBLMJN-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.7.0	S1[Fe]234[S@H]5[Fe]2678[Fe]592[S@H]3[Fe]493(S26)S[Fe]3234[Fe]1156[Fe]722(S8)[S@@H]1[Fe]5([S@@H]63)S24
OpenEye OEToolkits 1.7.0	S1[Fe]234S5[Fe]2678[Fe]592S3[Fe]493(S26)S[Fe]3234[Fe]1156[Fe]722(S8)S1[Fe]5(S63)S24
CACTVS 3.370	S1[Fe]\|23\|4\|5[SH]6[Fe]\|78\|2[SH]3[Fe]9%10\|4S[Fe]\|%11\|%12%13%14[SH]%15[Fe]1%16\|5\|%11[SH]%17[Fe]\|%18\|%12%16(S[Fe]6\|79\|%18[SH]8%10)[SH]%13[Fe]%14%15%17
CACTVS 3.370	S1[Fe]\|23\|4\|5[SH]6[Fe]\|78\|2[SH]3[Fe]9%10\|4S[Fe]\|%11\|%12%13%14[SH]%15[Fe]1%16\|5\|%11[SH]%17[Fe]\|%18\|%12%16(S[Fe]6\|79\|%18[SH]8%10)[SH]%13[Fe@@]%14%15%17

Name:

L-Cluster (Fe8S9)

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).