Structure of PDB 5dcx Chain J Binding Site BS01

Receptor Information
>5dcx Chain J (length=185) Species: 10804 (adeno-associated virus 2) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GFYEIVIKVPSDLDGHLPGISDSFVNWVAEKEWELPPDSDMDLNLIEQAP
LTVAEKLQRDFLTEWRRVSKAPEALFFVQFEKGESYFHMHVLVETTGVKS
MVLGRFLSQIREKLIQRIYRGIEPTLPNWFAVTKTRGNKVVDESYIPNYL
LPKTQPELQWAWTNMEQYLSACLNLTERKRLVAQH
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 chain5dcx Chain J Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB5dcx Structural Studies of AAV2 Rep68 Reveal a Partially Structured Linker and Compact Domain Conformation.
Resolution2.6 Å
Binding residue
(original residue number in PDB)		E83 H90 H92
Binding residue
(residue number reindexed from 1)		E81 H88 H90
Annotation score1
Enzymatic activity
Enzyme Commision number 3.6.4.12: DNA helicase.
External links
PDB RCSB:5dcx, PDBe:5dcx, PDBj:5dcx
PDBsum5dcx
PubMed26314310
UniProtP03132|REP68_AAV2S Protein Rep68 (Gene Name=Rep68)

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