Structure of PDB 5xfe Chain A Binding Site BS02

Receptor Information
>5xfe Chain A (length=306) Species: 7054 (Photinus pyralis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PVVEKIAELGKYTVGEGPHWDHETQTLYFVDTVEKTFHKYVPSQKKYTFC
KVDKLVSFIIPLAGSPGRFVVSLEREIAILTWDGVSAAPTSIEAIVNVEP
HIKNNRLNDGKADPLGNLWTGTMAIDAGLPIGPVTGSLYHLGADKKVKMH
ESNIAIANGLAWSNDLKKMYYIDSGKRRVDEYDYDASTLSISNQRPLFTF
EKHEVPGYPDGQTIDEEGNLWVAVFQGQRIIKISTQQPEVLLDTVKIPDP
QVTSVAFGGPNLDELYVTSAGLQLDDSSFDKSLVNGHVYRVTGLGVKGFA
GVKVKL
Ligand information
Ligand IDHG
InChIInChI=1S/Hg/q+2
InChIKeyBQPIGGFYSBELGY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Hg++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Hg+2]
FormulaHg
NameMERCURY (II) ION
ChEMBL
DrugBank
ZINC
PDB chain5xfe Chain A Residue 402 [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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PDB5xfe Experimental phase determination with selenomethionine or mercury-derivatization in serial femtosecond crystallography
Resolution1.5 Å
Binding residue
(original residue number in PDB)		C52 W84
Binding residue
(residue number reindexed from 1)		C50 W82
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004341 gluconolactonase activity
GO:0005509 calcium ion binding
GO:0046872 metal ion binding
Biological Process
GO:0019853 L-ascorbic acid biosynthetic process

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Molecular Function
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Biological Process
External links
PDB RCSB:5xfe, PDBe:5xfe, PDBj:5xfe
PDBsum5xfe
PubMed28989719
UniProtQ95YI4

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