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BioLiP

PDB CCD ID: T2N
Number of entries in BioLiP: 8
Chemical formula: Fe4 O2 S2
InChI: InChI=1S/4Fe.2O.2S/q;;;;;;;+1
InChIKey: ZZXANUDJVNRRAL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385
OpenEye OEToolkits 2.0.7		O1[Fe]O[Fe]2S[Fe][S+]2[Fe]1
CACTVS 3.385O1[Fe]O[Fe]2S[Fe][S@+]2[Fe]1
Name:3,5-dioxa-7-thia-1-thionia-2$l^{2},4$l^{2},6$l^{3},8$l^{2}-tetraferrabicyclo[4.2.0]octane
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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