BioLiP

PDB

BioLiP

PDB CCD ID:

OEX

Number of entries in BioLiP:

494

Chemical formula:

Ca Mn4 O5

InChI:

InChI=1S/Ca.4Mn.5O

InChIKey:

SEXWDHMBWJEXOJ-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.370	O12\|[Ca]3O4\|[Mn]1O5\|[Mn]2[O]36[Mn]O[Mn@]456
CACTVS 3.370	O12\|[Ca]3O4\|[Mn]1O5\|[Mn]2[O]36[Mn]O[Mn]456
OpenEye OEToolkits 1.7.0	O1[Mn]O23[Mn]14O5[Ca]2O6[Mn]5O4[Mn]36
OpenEye OEToolkits 1.7.0	O1[Mn][O@]23[Mn@@]14[O@]5[Ca]2[O@@]6[Mn]5[O@]4[Mn]36

Name:

CA-MN4-O5 CLUSTER

Reference:

Chengxin Zhang, Xi Zhang, Lydia 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).