Chemical Components in the PDB

pdbe.org/chem
spacer

F3S : Summary

Code

F3S

One-letter code

X

Molecule name

FE3-S4 CLUSTER

Systematic names

Not Assigned

Formula

Fe3 S4

Formal charge

0

Molecular weight

295.795 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.341 S1[Fe]|2S[Fe]3S|2[Fe]1S3
SMILES OpenEye OEToolkits 1.5.0 S1[Fe]2S[Fe]3[S]2[Fe]1S3
Canonical SMILES CACTVS 3.341 S1[Fe]|2S[Fe]3S|2[Fe]1S3
Canonical SMILES OpenEye OEToolkits 1.5.0 S1[Fe]2S[Fe]3[S]2[Fe]1S3

IUPAC InChI

InChI=1/3Fe.4S/rFe3S4/c4-1-5-3-6-2(4)7(1)3

IUPAC InChI key

FCXHZBQOKRZXKS-MZMDZPPWAW
F3S

wwPDB Information

Atom count

7 (7 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2018-05-30

Status

Released

Obsoleted

Not Assigned