Structure of PDB 2b30 Chain D Binding Site BS01

Receptor Information
>2b30 Chain D (length=284) Species: 5855 (Plasmodium vivax) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KVEEALKGADIKLLLIDFDGTLFVDKDIKVPSENIDAIKEAIEKGYMVSI
CTGRSKVGILSAFGEENLKKMNFYGMPGVYINGTIVYDQIGYTLLDETIE
TDVYAELISYLVEKNLVNQTIFHRGESNYVTEDNKYADFLQKMYSENRSI
IIRHNEMLKYRTMNKLMIVLDPSESKTVIGNLKQKFKNKLTIFTTYNGHA
EVTKLGHDKYTGINYLLKHYNISNDQVLVVGDAENDIAMLSNFKYSFAVA
NATDSAKSHAKCVLPVSHREGAVAYLLKKVFDLK
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 chain2b30 Chain D Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2b30 Initial Crystallographic Structural Analysis of a putative HAD/COF-like hydrolase from Plasmodium vivax
Resolution2.7 Å
Binding residue
(original residue number in PDB)		D33 D35 D248
Binding residue
(residue number reindexed from 1)		D17 D19 D232
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000287 magnesium ion binding
GO:0003824 catalytic activity
GO:0016787 hydrolase activity
GO:0016791 phosphatase activity
GO:0046872 metal ion binding
Cellular Component
GO:0005829 cytosol

View graph for
Molecular Function
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Cellular Component
External links
PDB RCSB:2b30, PDBe:2b30, PDBj:2b30
PDBsum2b30
PubMed
UniProtA5K063

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