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BioLiP

PDB CCD ID: RQM
Number of entries in BioLiP: 7
Chemical formula: Fe4 Ni S4
InChI: InChI=1S/4Fe.Ni.4S
InChIKey: QGLWBXDZIHZONR-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385[Fe]S[Fe].S1[Fe]S[Ni]S[Fe]1
OpenEye OEToolkits 2.0.7[S]1([Fe]2[S]3[Fe]1[S]4[Fe]3[S]2[Ni]4)[Fe]
Name:Fe(3)-Ni(1)-S(4) cluster
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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