BioLiP

PDB

BioLiP

PDB CCD ID:

OEY

Number of entries in BioLiP:

111

Chemical formula:

Ca Mn4 O6

InChI:

InChI=1S/Ca.4Mn.O2.4O/c;;;;;1-2;;;;/q;;;;+1;-1;;;;

InChIKey:

VXLJVOKMVCJEPF-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.6	O1O23[Ca]4O5[Mn]1O6[Mn]5O4[Mn]62O[Mn]3
CACTVS 3.385	O1[Mn]O[O]23[Ca]O[Mn]2(O[Mn]1)O[Mn]3
CACTVS 3.385	O1[Mn]O[O]23[Ca]O[Mn@]2(O[Mn]1)O[Mn]3

Name:

CA-MN4-O6 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).