Chemical Components in the PDB

pdbe.org/chem
wwPDB
EMDataBank
spacer

CLP : Summary

Code

CLP

One-letter code

X

Molecule name

FE-S CLUSTER

Systematic names

Not Assigned

Formula

Fe8 S8

Formal charge

0

Molecular weight

703.28 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 S1[Fe]S[Fe]2S[Fe][S]2([Fe]1)[S]34[Fe]S[Fe]S[Fe]3S[Fe]4
SMILES OpenEye OEToolkits 2.0.7 [S]12[Fe]3[S]4[Fe]1S5([Fe]2[S]3[Fe]45)S67[Fe]8[S]9[Fe]6[S]1[Fe]9[S]8[Fe]71
Canonical SMILES CACTVS 3.385 S1[Fe]S[Fe]2S[Fe][S]2([Fe]1)[S]34[Fe]S[Fe]S[Fe]3S[Fe]4
Canonical SMILES OpenEye OEToolkits 2.0.7 [S]12[Fe]3[S]4[Fe]1S5([Fe]2[S]3[Fe]45)S67[Fe]8[S]9[Fe]6[S]1[Fe]9[S]8[Fe]71

IUPAC InChI

InChI=1S/8Fe.S2.6S/c;;;;;;;;1-2;;;;;;

IUPAC InChI key

MJXAKWFPOPRKKV-UHFFFAOYSA-N
CLP

wwPDB Information

Atom count

16 (16 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

2023-09-23

Status

Released

Obsoleted

Not Assigned