Chemical Components in the PDB

pdbe.org/chem
spacer

DGN : Summary

Code

DGN

One-letter code

Q

Molecule name

D-GLUTAMINE

Systematic names

ProgramVersionName
ACDLabs 10.04 D-glutamine
OpenEye OEToolkits 1.5.0 (2R)-2,5-diamino-5-oxo-pentanoic acid

Formula

C5 H10 N2 O3

Formal charge

0

Molecular weight

146.144 Da

SMILES

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

IUPAC InChI

InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m1/s1

IUPAC InChI key

ZDXPYRJPNDTMRX-GSVOUGTGSA-N
DGN

wwPDB Information

Atom count

20 (10 without Hydrogen)

Polymer type

Amino Acid

Type description

D-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

GLN

Defined at

1999-07-08

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned