Structure of PDB 9d8s Chain A Binding Site BS05

Receptor Information

>9d8s Chain A (length=414) Species: 353152 (Cryptosporidium parvum Iowa II) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

MGTFAERYNIVCMLGKGSFGEVLKCKDRITQQEYAVKVINKASAKTSTIL
REVELLKKLDHPNIMKLFEILEDSSSFYIVGELYTGGELFDEIIKRKRFS
EHDAARIIKQVFSGITYMHKHNIVHRDLKPENILLESKEKDCDIKIIDFG
LSTCFQQNTKMKDRIGTAYYIAPEVLRGTYDEKCDVWSAGVILYILLSGT
PPFYGKNEYDILKRVETGKYAFDLPQWRTISDDAKDLIRKMLTFHPSLRI
TATQCLEHPWIQKYSSETPTISDLPSLESAMTNIRQFQAEKKLAQAALLY
MASKLTTLDETKQLTEIFRKLDTNNDGMLDRDELVRGYHEFMRLKGVDSN
SLIQGSTIEDQIDSLMPLLDMDGSGSIEYSEFIASAIDRTILLSRERMER
AFKMFFNEFVEMLQ

Ligand information

Ligand ID

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

Name

MAGNESIUM ION

PDB chain

9d8s Chain A Residue 605 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure

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Structure summary

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PDB	9d8s Crystal Structure of calcium-dependent protein kinase 1 (CDPK1) from Cryptosporidium parvum (AMP/Mg bound)
Resolution	2.12 Å
Binding residue (original residue number in PDB)	D144 S146
Binding residue (residue number reindexed from 1)	D73 S75
Annotation score	4

External links

PDB	RCSB:9d8s, PDBe:9d8s, PDBj:9d8s
PDBsum	9d8s
PubMed
UniProt	A3FQ16

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