Chemical Components in the PDB

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GLJ : Summary

Code

GLJ

One-letter code

E

Molecule name

5,5-dihydroxy-L-norvaline

Systematic names

ProgramVersionName
ACDLabs 12.01 5,5-dihydroxy-L-norvaline
OpenEye OEToolkits 1.7.0 (2S)-2-azanyl-5,5-dihydroxy-pentanoic acid

Formula

C5 H11 N O4

Formal charge

0

Molecular weight

149.145 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 O=C(O)C(N)CCC(O)O
SMILES CACTVS 3.370 N[CH](CCC(O)O)C(O)=O
SMILES OpenEye OEToolkits 1.7.0 C(CC(O)O)C(C(=O)O)N
Canonical SMILES CACTVS 3.370 N[C@@H](CCC(O)O)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.7.0 C(CC(O)O)[C@@H](C(=O)O)N

IUPAC InChI

InChI=1S/C5H11NO4/c6-3(5(9)10)1-2-4(7)8/h3-4,7-8H,1-2,6H2,(H,9,10)/t3-/m0/s1

IUPAC InChI key

FIKXYBCGRJPSSD-VKHMYHEASA-N
GLJ

wwPDB Information

Atom count

21 (10 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

GLU

Defined at

2011-02-09

Last modified at

2023-11-03

Status

Released

Obsoleted

Not Assigned