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BioLiP

PDB CCD ID: CUN
Number of entries in BioLiP: 4
Chemical formula: Cu H Mo O2 S
InChI: InChI=1S/Cu.Mo.H2O.O.S/h;;1H2;;/q+1;+5;;;/p-1
InChIKey: GIYZUGIRDQLYSY-UHFFFAOYSA-M
SMILES:
SoftwareSMILES
CACTVS 3.370
OpenEye OEToolkits 1.7.2		O[Mo+4](=O)S[Cu+]
ACDLabs 12.01[Cu+]S[Mo+4](=O)O
Name:CU(I)-S-MO(IV)(=O)OH 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)(download the PDF file).
  • 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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