BioLiP

PDB

BioLiP

PDB CCD ID:

A1IM7

Number of entries in BioLiP:

Chemical formula:

C6 H12 N2 O3

InChI:

InChI=1S/C6H12N2O3/c1-8-6(11)4(7)2-3-5(9)10/h4H,2-3,7H2,1H3,(H,8,11)(H,9,10)/t4-/m0/s1

InChIKey:

NIAZSSTYQBLIPW-BYPYZUCNSA-N

SMILES:

Software	SMILES
CACTVS 3.385	CNC(=O)[C@@H](N)CCC(O)=O
OpenEye OEToolkits 2.0.7	CNC(=O)C(CCC(=O)O)N
CACTVS 3.385	CNC(=O)[CH](N)CCC(O)=O

Name:

C-methylamino-glutamic acid

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).