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BioLiP

PDB CCD ID: ZKP
Number of entries in BioLiP: 2
Chemical formula: C H3 Fe3 S4
InChI: InChI=1S/CH3S.3Fe.3S/c1-2;;;;;;/h1H3;;;;;;
InChIKey: NMYMZQNZHUHIMW-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7C[S]1[Fe]2S[Fe]3[S]2[Fe]1S3
CACTVS 3.385CS[Fe]1S[Fe]S[Fe]S1
Name:FE3-S4 methylated 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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