BioLiP

PDB

BioLiP

PDB CCD ID:

MEQ

Number of entries in BioLiP:

Chemical formula:

C6 H12 N2 O3

InChI:

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

InChIKey:

ONXPDKGXOOORHB-BYPYZUCNSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	CNC(=O)CC[C@@H](C(=O)O)N
ACDLabs 10.04	O=C(O)C(N)CCC(=O)NC
CACTVS 3.341	CNC(=O)CC[CH](N)C(O)=O
OpenEye OEToolkits 1.5.0	CNC(=O)CCC(C(=O)O)N
CACTVS 3.341	CNC(=O)CC[C@H](N)C(O)=O

Name:

N5-METHYLGLUTAMINE

DrugBank:

DB03473

ZINC:

ZINC000001529600

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).