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BioLiP

PDB CCD ID: CA
Number of entries in BioLiP: 44457
Chemical formula: Ca
InChI: InChI=1S/Ca/q+2
InChIKey: BHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
Name:CALCIUM ION
DrugBank: DB14577
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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