Structure of PDB 2jh3 Chain B Binding Site BS01

Receptor Information
>2jh3 Chain B (length=459) Species: 1299 (Deinococcus radiodurans) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GALRSLVLIGHGSHHHGESARATQQVAEALRGRGLAGHLPYDEVLEGYWQ
QEPGLRQVLRTVAYSDVTVVPVFLSEGYVTETVLPRELGLGHQGPVPTGG
VVRVLGGRRVRYTRPLGAHPGMADAIAAQARDTLPEGTDPADVTLLLLAA
RPGNAALETHAQALRERGQFAGVEVVLESRESAVPLSEWPSRVEAGQAVL
VPFLTHLGKHAAERLQQALAQAAERFPQAPPLHVGGPVGEHPAVAEVVLA
LAAEGREDERGGDIDQAHAEAWAALRHLAERGGRLGEVLLTPYGGLFELR
HTLDEGRATLDLQTVVTPEGLRDLTARDEAGRWRPIRTWRTLPRGWRAVL
SPADLRLGLELLYPAVIEESYAHEHRRLHWTPWMSTARRQTGTLARVQRA
TPDQVDTVAAQVCASCLRTRLWAGHTLGQTIFSGVPGGLPCAEACTVLLA
AVRDEVGRE
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 chain2jh3 Chain B Residue 650 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2jh3 The Crystal Structure of Dr2241 from Deinococcus Radiodurans at 1.9 A Resolution Reveals a Multi-Domain Protein with Structural Similarity to Chelatases But Also with Two Additional Novel Domains
Resolution1.9 Å
Binding residue
(original residue number in PDB)		C420 C423 C448 C452 L455
Binding residue
(residue number reindexed from 1)		C413 C416 C441 C445 L448
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016829 lyase activity
GO:0046872 metal ion binding
GO:0051539 4 iron, 4 sulfur cluster binding
Cellular Component
GO:0005840 ribosome

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Molecular Function
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Cellular Component
External links
PDB RCSB:2jh3, PDBe:2jh3, PDBj:2jh3
PDBsum2jh3
PubMed17448684
UniProtQ9RS86

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