Structure of PDB 7q9v Chain A Binding Site BS03

Receptor Information
>7q9v Chain A (length=133) Species: 5833 (Plasmodium falciparum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SKNVVIYADGVYDMLHLGHMKQLEQAKKLFENTTLIVGVTSDNETKLFKG
QVVQTLEERTETLKHIRWVDEIISPCPWVVTPEFLEKYKIDYVAHDDIYA
WLKRAGKFKATQRTEGVSTTDLIVRILKNYEDY
Ligand information
Ligand ID9OI
InChIInChI=1S/C4H6N2O/c5-1-4-2-7-3-6-4/h2-3H,1,5H2
InChIKeyULZXEYFKBUPRQM-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385NCc1cocn1
OpenEye OEToolkits 2.0.7c1c(nco1)CN
FormulaC4 H6 N2 O
Name1,3-oxazol-4-ylmethanamine
ChEMBL
DrugBank
ZINCZINC000002527145
PDB chain7q9v Chain A Residue 806 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7q9v Crystallographic screening using ultra-low-molecular-weight ligands to guide drug design of PfCCT inhibitors
Resolution1.5 Å
Binding residue
(original residue number in PDB)		V766 L769 K770
Binding residue
(residue number reindexed from 1)		V124 L127 K128
Annotation score1
Enzymatic activity
Enzyme Commision number 2.7.7.15: choline-phosphate cytidylyltransferase.
Gene Ontology
Molecular Function
GO:0003824 catalytic activity
GO:0004105 choline-phosphate cytidylyltransferase activity
Biological Process
GO:0006657 CDP-choline pathway
GO:0009058 biosynthetic process

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Molecular Function
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Biological Process
External links
PDB RCSB:7q9v, PDBe:7q9v, PDBj:7q9v
PDBsum7q9v
PubMed
UniProtQ8IEE9

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