Structure of PDB 3s9y Chain A

Receptor sequence
>3s9yA (length=331) Species: 36329 (Plasmodium falciparum 3D7) [Search protein sequence]
SGLVPRGSMGFKVKLEKRRNAINTCLCIGLDPDEKDIENFMKNEKENNYN
NIKKNLKEKYINNVSIKKDILLKAPDNIIREEKSEEFFYFFNHFCFYIIN
ETNKYALTFKMNFAFYIPYGSVGIDVLKNVFDYLYELNIPTILDMKINDI
GNTVKNYRKFIFEYLKSDSCTVNIYMGTNMLKDICYDEEKNKYYSAFVLV
KTTNPDSAIFQKNLSLDNKQAYVIMAQEALNMSSYLNLEQNNEFIGFVVG
ANSYDEMNYIRTYFPNCYILSPGIGAQNGDLHKTLTNGYHKSYEKILINI
GRAITKNPYPQKAAQMYYDQINAILKQNMES
3D structure
PDB3s9y Structure-activity relationships of orotidine-5'-monophosphate decarboxylase inhibitors as anticancer agents.
ChainA
Resolution1.7 Å
3D
structure
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Enzymatic activity
Enzyme Commision number 4.1.1.23: orotidine-5'-phosphate decarboxylase.
Interaction with ligand
Site
#
Ligand Ligand
chain
Binding residues on receptor
(original residue number in PDB)
Binding residues on receptor
(residue number reindexed from 1)
Binding affinity
BS01 FNU A D23 K102 N104 D136 K138 T194 T195 P264 Q269 G293 R294 D31 K110 N112 D144 K146 T202 T203 P272 Q277 G301 R302 MOAD: Ki=16.6uM
PDBbind-CN: -logKd/Ki=6.44,Ki=0.36uM
BS02 FNU A D141 I142 T145 D149 I150 T153 MOAD: Ki=16.6uM
PDBbind-CN: -logKd/Ki=6.44,Ki=0.36uM
Gene Ontology
Molecular Function
GO:0004590 orotidine-5'-phosphate decarboxylase activity
GO:0005515 protein binding
GO:0016831 carboxy-lyase activity
Biological Process
GO:0006207 'de novo' pyrimidine nucleobase biosynthetic process
GO:0006221 pyrimidine nucleotide biosynthetic process
GO:0044205 'de novo' UMP biosynthetic process

View graph for
Molecular Function

View graph for
Biological Process
External links
PDB RCSB:3s9y, PDBe:3s9y, PDBj:3s9y
PDBsum3s9y
PubMed19260677
UniProtQ8IJH3

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