BioLiP

PDB

BioLiP

PDB CCD ID:

CSB

Number of entries in BioLiP:

Chemical formula:

C3 H6 N O2 Pb S

InChI:

InChI=1S/C3H7NO2S.Pb.2H/c4-2(1-7)3(5)6;;;/h2,7H,1,4H2,(H,5,6);;;/q;+2;;/p-1/t2-;;;/m0.../s1

InChIKey:

KYXRXTHUWWTZJI-SQGDDOFFSA-M

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C([C@@H](C(=O)O)N)S[Pb+]
CACTVS 3.341	N[CH](CS[Pb+])C(O)=O
CACTVS 3.341	N[C@@H](CS[Pb+])C(O)=O
OpenEye OEToolkits 1.5.0	C(C(C(=O)O)N)S[Pb+]

Name:

CYS BOUND TO LEAD ION

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).