BioLiP

PDB

BioLiP

PDB CCD ID:

DDZ

Number of entries in BioLiP:

Chemical formula:

C3 H7 N O4

InChI:

InChI=1S/C3H7NO4/c4-1(2(5)6)3(7)8/h1-2,5-6H,4H2,(H,7,8)/t1-/m0/s1

InChIKey:

WBZJYDPZNNYSJU-SFOWXEAESA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.6.1	C(C(O)O)(C(=O)O)N
CACTVS 3.352	N[CH](C(O)O)C(O)=O
OpenEye OEToolkits 1.6.1	[C@H](C(O)O)(C(=O)O)N
ACDLabs 10.04	O=C(O)C(N)C(O)O
CACTVS 3.352	N[C@@H](C(O)O)C(O)=O

Name:

3,3-DIHYDROXY L-ALANINE;
3-HYDROXY-L-SERINE

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).