Structure of PDB 3wjr Chain A Binding Site BS02

Receptor Information
>3wjr Chain A (length=336) Species: 69014 (Thermococcus kodakarensis KOD1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EKIKLEHGAGGEIMEELLRDVILKTLTLKSAGGIGLDALDDGATIPFGDK
HIVFTIDGHTVKPLFFPGGDIGRLAVSGTVNDLAVMGAEPIALANSMIIG
EGLDMEVLKRVLKSMDETAREVPVPIVTGDTKVVEDKIEMFVITAGIGIA
EHPVSDAGAKVGDAVLVSGTIGDHGIALMSHREGIAFETELKSDVAPIWD
VVKAVAETIGWENIHAMKDPTRAGLSNALNEIARKSNVGILVREADIPIR
PEVRAASEMLGISPYDVANEGKVVMVVAREYAEEALEAMRKTEKGRNAAI
IGEVIADYRGKVLLETGIGGKRFMEPPEGDPVPRIC
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain3wjr Chain A Residue 412 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3wjr Crystal structures of the carbamoylated and cyanated forms of HypE for [NiFe] hydrogenase maturation
Resolution1.864 Å
Binding residue
(original residue number in PDB)		D43 D84
Binding residue
(residue number reindexed from 1)		D41 D82
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005515 protein binding
GO:0005524 ATP binding
GO:0046872 metal ion binding
Biological Process
GO:0051604 protein maturation

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Molecular Function
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Biological Process
External links
PDB RCSB:3wjr, PDBe:3wjr, PDBj:3wjr
PDBsum3wjr
PubMed24297906
UniProtQ5JII7

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