Chemical Components in the PDB

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FE : Summary

Code

FE

One-letter code

X

Molecule name

FE (III) ION

Systematic names

ProgramVersionName
ACDLabs 10.04 iron(3+)
OpenEye OEToolkits 1.5.0 iron(+3) cation

Formula

Fe

Formal charge

3

Molecular weight

55.845 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 [Fe+3]
SMILES CACTVS 3.341 [Fe+3]
SMILES OpenEye OEToolkits 1.5.0 [Fe+3]
Canonical SMILES CACTVS 3.341 [Fe+3]
Canonical SMILES OpenEye OEToolkits 1.5.0 [Fe+3]

IUPAC InChI

InChI=1S/Fe/q+3

IUPAC InChI key

VTLYFUHAOXGGBS-UHFFFAOYSA-N
FE

wwPDB Information

Atom count

1 (1 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAI

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned