BioLiP

PDB

BioLiP

PDB CCD ID:

9R7

Number of entries in BioLiP:

Chemical formula:

C7 H12 N2 O5

InChI:

InChI=1S/C7H12N2O5/c8-4(7(13)14)1-2-5(10)9-3-6(11)12/h4H,1-3,8H2,(H,9,10)(H,11,12)(H,13,14)/t4-/m0/s1

InChIKey:

ACIJGUBIMXQCMF-BYPYZUCNSA-N

SMILES:

Software	SMILES
CACTVS 3.385	N[CH](CCC(=O)NCC(O)=O)C(O)=O
OpenEye OEToolkits 2.0.6	C(CC(=O)NCC(=O)O)C(C(=O)O)N
OpenEye OEToolkits 2.0.6	C(CC(=O)NCC(=O)O)[C@@H](C(=O)O)N
ACDLabs 12.01	NC(CCC(NCC(O)=O)=O)C(=O)O
CACTVS 3.385	N[C@@H](CCC(=O)NCC(O)=O)C(O)=O

Name:

L-gamma-glutamylglycine

ZINC:

ZINC000001576202

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).