Structure of PDB 3tbo Chain A Binding Site BS01

Receptor Information
>3tbo Chain A (length=54) Species: 410359 (Pyrobaculum calidifontis JCM 11548) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VEIRAIENGPYEVKIAIYLCRCGHSGSKPHCDGTHAKVGFKAPGAKIVHH
HHHH
Ligand information
Ligand IDFES
InChIInChI=1S/2Fe.2S
InChIKeyNIXDOXVAJZFRNF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04[Fe]1S[Fe]S1
CACTVS 3.341
OpenEye OEToolkits 1.5.0		S1[Fe]S[Fe]1
FormulaFe2 S2
NameFE2/S2 (INORGANIC) CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain3tbo Chain A Residue 61 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3tbo Structure and Molecular Evolution of CDGSH Iron-Sulfur Domains.
Resolution1.5 Å
Binding residue
(original residue number in PDB)		C25 R26 C27 S30 C36 D37 G38 T39 H40
Binding residue
(residue number reindexed from 1)		C20 R21 C22 S25 C31 D32 G33 T34 H35
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
GO:0051537 2 iron, 2 sulfur cluster binding
Cellular Component
GO:0005737 cytoplasm
GO:0043231 intracellular membrane-bounded organelle

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Molecular Function
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Cellular Component
External links
PDB RCSB:3tbo, PDBe:3tbo, PDBj:3tbo
PDBsum3tbo
PubMed21949752
UniProtA3MW14

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