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BioLiP

PDB CCD ID: CD3
Number of entries in BioLiP: 0
Chemical formula: Cd H6 O3
InChI: InChI=1/Cd.3H2O/h;3*1H2/q+2;;;/rCdH6O3/c2-1(3)4/h2-4H2/q+2
InChIKey: NGHYQUMORBCTRL-SDPWMMMHAT
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0[OH2][Cd+2]([OH2])[OH2]
CACTVS 3.341O|[Cd++](|O)|O
Name:CADMIUM ION, 3 WATERS COORDINATED
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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