BioLiP

PDB

BioLiP

PDB CCD ID:

4FO

Number of entries in BioLiP:

Chemical formula:

C4 H10 N2 O2

InChI:

InChI=1S/C4H10N2O2/c5-2-1-3(6)4(7)8/h3H,1-2,5-6H2,(H,7,8)/t3-/m1/s1

InChIKey:

OGNSCSPNOLGXSM-GSVOUGTGSA-N

SMILES:

Software	SMILES
CACTVS 3.385	NCC[C@@H](N)C(O)=O
CACTVS 3.385	NCC[CH](N)C(O)=O
OpenEye OEToolkits 1.7.6	C(CN)C(C(=O)O)N
OpenEye OEToolkits 1.7.6	C(CN)[C@H](C(=O)O)N
ACDLabs 12.01	NC(CCN)C(=O)O

Name:

(2R)-2,4-diaminobutanoic acid

ChEMBL:

CHEMBL102493

ZINC:

ZINC000053122793

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).