Structure of PDB 7fsb Chain B Binding Site BS03
Receptor Information
>7fsb Chain B (length=436) Species:
9606
(Homo sapiens) [
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RADVAQLTQELGTAFFQQQQLPAAMADTFLEHLCLLDIDSEPVAARSTSI
IATIGPASRSVERLKEMIKAGMNIARLNFSHGSHEYHAESIANVREAVES
FAGSPLSYRPVAIALDTKGPGSGPGLSEQDVRDLRFGVEHGVDIVFASFV
RKASDVAAVRAALGPEGHGIKIISKIENHEGVKRFDEILEVSDGIMVARG
DLGIEIPAEKVFLAQKMMIGRCNLAGKPVVCATQMLESMITKPRPTRAET
SDVANAVLDGADCIMLSGETAKGNFPVEAVKMQHAIAREAEAAVYHRQLF
EELRRAAPLSRDPTEVTAIGAVEAAFKCCAAAIIVLTTTGRSAQLLSRYR
PRAAVIAVTRSAQAARQVHLCRGVFPLLYREPPEAIWADDVDRRVQFGIE
SGKLRGFLRVGDLVIVVTGWRPGSGYTNIMRVLSIS
Ligand information
Ligand ID
MG
InChI
InChI=1S/Mg/q+2
InChIKey
JLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Mg+2]
CACTVS 3.341
[Mg++]
Formula
Mg
Name
MAGNESIUM ION
ChEMBL
DrugBank
DB01378
ZINC
PDB chain
7fsb Chain B Residue 603 [
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Receptor-Ligand Complex Structure
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PDB
7fsb
Tuning liver pyruvate kinase activity up or down with a new class of allosteric modulators.
Resolution
2.495 Å
Binding residue
(original residue number in PDB)
E284 D308
Binding residue
(residue number reindexed from 1)
E177 D201
Annotation score
1
Enzymatic activity
Enzyme Commision number
2.7.1.40
: pyruvate kinase.
Gene Ontology
Molecular Function
GO:0000287
magnesium ion binding
GO:0003824
catalytic activity
GO:0004743
pyruvate kinase activity
GO:0030955
potassium ion binding
Biological Process
GO:0006096
glycolytic process
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Molecular Function
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Biological Process
External links
PDB
RCSB:7fsb
,
PDBe:7fsb
,
PDBj:7fsb
PDBsum
7fsb
PubMed
36753880
UniProt
P30613
|KPYR_HUMAN Pyruvate kinase PKLR (Gene Name=PKLR)
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