Structure of PDB 4qlz Chain A Binding Site BS03

Receptor Information
>4qlz Chain A (length=284) Species: 6182 (Schistosoma japonicum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MSVERGTSNSASYKMFLTHGGSPISYFHDVPLFADATNNCYNMIVEIPRW
TNAKMEICKEELMNPIKHDVKNNKLRYIYNVFPHKGYIWNYGALPQTWED
PSYVDEDTKAKGDNDPIDVCEIGSKIWPSGSVIPVKVLGILGMIDEGETD
WKVIAINVADPMAEKLNDILDVDAHMPGFLKATRDWFKYYKVPAGKPENS
FAFNGEFKNKEFAAKIISKTHEHWQKLISTKVEAGPIIRANVTVKGSPYM
VSKEDFIDALQKHEDFKRGSEPTDQAIEQWHFCN
Ligand information
Ligand IDCO
InChIInChI=1S/Co/q+2
InChIKeyXLJKHNWPARRRJB-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Co+2]
CACTVS 3.341[Co++]
FormulaCo
NameCOBALT (II) ION
ChEMBL
DrugBankDB14205
ZINC
PDB chain4qlz Chain A Residue 404 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4qlz Study on the structure and function of inorganic pyrophosphatase from Schistosoma japonicum
Resolution2.326 Å
Binding residue
(original residue number in PDB)		D145 D150
Binding residue
(residue number reindexed from 1)		D145 D150
Annotation score1
Enzymatic activity
Enzyme Commision number 3.6.1.1: inorganic diphosphatase.
Gene Ontology
Molecular Function
GO:0000287 magnesium ion binding
GO:0004427 inorganic diphosphate phosphatase activity
GO:0016787 hydrolase activity
GO:0046872 metal ion binding
Biological Process
GO:0006796 phosphate-containing compound metabolic process
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:4qlz, PDBe:4qlz, PDBj:4qlz
PDBsum4qlz
PubMed
UniProtQ5DE13

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