Chemical Components in the PDB

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OGA : Summary

Code

OGA

One-letter code

X

Molecule name

N-OXALYLGLYCINE

Systematic names

ProgramVersionName
ACDLabs 10.04 N-(carboxycarbonyl)glycine
OpenEye OEToolkits 1.5.0 2-(carboxymethylamino)-2-oxo-ethanoic acid

Formula

C4 H5 N O5

Formal charge

0

Molecular weight

147.086 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=C(O)C(=O)NCC(=O)O
SMILES CACTVS 3.341 OC(=O)CNC(=O)C(O)=O
SMILES OpenEye OEToolkits 1.5.0 C(C(=O)O)NC(=O)C(=O)O
Canonical SMILES CACTVS 3.341 OC(=O)CNC(=O)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 C(C(=O)O)NC(=O)C(=O)O

IUPAC InChI

InChI=1S/C4H5NO5/c6-2(7)1-5-3(8)4(9)10/h1H2,(H,5,8)(H,6,7)(H,9,10)

IUPAC InChI key

BIMZLRFONYSTPT-UHFFFAOYSA-N
OGA

wwPDB Information

Atom count

15 (10 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2002-08-12

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned