BioLiP

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BioLiP

PDB CCD ID:

Number of entries in BioLiP:

Chemical formula:

C H5 N O3 S

InChI:

InChI=1S/CH5NO3S/c2-1-6(3,4)5/h1-2H2,(H,3,4,5)

InChIKey:

OBESRABRARNZJB-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C(N)S(=O)(=O)O
ACDLabs 12.01	NCS(=O)(=O)O
CACTVS 3.385	NC[S](O)(=O)=O

Name:

aminomethanesulfonic acid

ChEMBL:

ZINC:

ZINC000008034708

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).

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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