Structure of PDB 8gt1 Chain B Binding Site BS01

Receptor Information
>8gt1 Chain B (length=152) Species: 5791 (Physarum polycephalum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
YNIADSNIANLGTELEKKVKLEASQHEDAWKGAGKQVGVEIWRIQQFKVV
PVPKKHHGSFYTGDSYIVLSTYHPKTNPDKLAYDVHFWLGAFTTQDEAGT
AAYKTVELDDYLGGLPVQYREVQGYESERFLSLFGGLRILDGGVETGFHH
VE
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain8gt1 Chain B Residue 201 [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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PDB8gt1 Mutagenic analysis of actin reveals the mechanism of His161 flipping that triggers ATP hydrolysis.
Resolution1.35 Å
Binding residue
(original residue number in PDB)		D115 G120 P122
Binding residue
(residue number reindexed from 1)		D109 G114 P116
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0051015 actin filament binding

View graph for
Molecular Function
External links
PDB RCSB:8gt1, PDBe:8gt1, PDBj:8gt1
PDBsum8gt1
PubMed37009486
UniProtQ94707

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