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0KA : Summary
Code
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0KA
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One-letter code
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X
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Molecule name
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SILVER/IRON/SULFUR CLUSTER
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Systematic names
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Not Assigned
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Formula
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Ag Fe3 S4
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Formal charge
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0
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Molecular weight
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403.663 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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CACTVS |
3.385 |
S1[Fe]S[Fe]1.S2[Fe]S[Ag]2 |
SMILES
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OpenEye OEToolkits |
1.9.2 |
[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Ag]45 |
Canonical SMILES
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CACTVS |
3.385 |
S1[Fe]S[Fe]1.S2[Fe]S[Ag]2 |
Canonical SMILES
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OpenEye OEToolkits |
1.9.2 |
[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Ag]45 |
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IUPAC InChI | InChI=1S/Ag.3Fe.4S |
IUPAC InChI key | FVQUTMRPEYETPT-UHFFFAOYSA-N |
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wwPDB Information |
Atom count
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8 (8 without Hydrogen)
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Polymer type
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Bound ligand
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Type description
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NON-POLYMER
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Type code
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HETAIN
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Is modified
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No
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Standard parent
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Not Assigned
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Defined at
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2012-01-31
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Last modified at
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2014-09-05
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Status
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Released
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Obsoleted
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Not Assigned
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