Structure of PDB 8d5v Chain A Binding Site BS01

Receptor Information
>8d5v Chain A (length=84) Species: 1773 (Mycobacterium tuberculosis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EVPLGVCTQDPDRWTTTPDDEAKTLCRACPRRWLCARDAVESAGAEGLWA
GVVIPESGRARAFALGQLRSLAERNGYPVRDHRV
Ligand information
Ligand IDSF4
InChIInChI=1S/4Fe.4S
InChIKeyLJBDFODJNLIPKO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45
CACTVS 3.385S1[Fe]S[Fe]1.S2[Fe]S[Fe]2
FormulaFe4 S4
NameIRON/SULFUR CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain8d5v Chain A Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8d5v Crystal structure of WhiB6 and SigA4-betaTip complex
Resolution1.8 Å
Binding residue
(original residue number in PDB)		G12 C14 W21 C33 C36 R38 C42 A57
Binding residue
(residue number reindexed from 1)		G5 C7 W14 C26 C29 R31 C35 A50
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003677 DNA binding
GO:0035731 dinitrosyl-iron complex binding
GO:0046872 metal ion binding
GO:0051539 4 iron, 4 sulfur cluster binding
Biological Process
GO:0006355 regulation of DNA-templated transcription
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:8d5v, PDBe:8d5v, PDBj:8d5v
PDBsum8d5v
PubMed
UniProtP9WF37|WHIB6_MYCTU Probable transcriptional regulator WhiB6 (Gene Name=whiB6)

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