Structure of PDB 5hue Chain A Binding Site BS02

Receptor Information
>5hue Chain A (length=447) Species: 1718 (Corynebacterium glutamicum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PPLPEGMQQQFEDTISRDAKQQPTWDRAQAENVRKILESVPPIVVAPEVL
ELKQKLADVANGKAFLLQGGDCAETFESNTEPHIRANVKTLLQMAVVLTY
GASTPVIKMARIAGQYAKPRSSDLDGNGLPNYRGDIVNGVEATPEARRHD
PARMIRAYANASAAMNLVRALTSSGTADLYRLSEWNREFVANSPAGARYE
ALAREIDSGLRFMEACGVSDESLRAADIYCSHEALLVDYERSMLRLATDE
EGNEELYDLSAHQLWIGERTRGMDDFHVNFASMISNPIGIKIGPGITPEE
AVAYADKLDPNFEPGRLTIVARMGHDKVRSVLPGVIQAVEASGHKVIWQS
DPMHGNTFTASNGYKTRHFDKVIDEVQGFFEVHRALGTHPGGIHIEFTGE
DVTECLGGAEDITDVDLPGRYESACDPRLNTQQSLELAFLVAEMLRN
Ligand information
Ligand IDPEP
InChIInChI=1S/C3H5O6P/c1-2(3(4)5)9-10(6,7)8/h1H2,(H,4,5)(H2,6,7,8)
InChIKeyDTBNBXWJWCWCIK-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C=C(C(=O)O)OP(=O)(O)O
CACTVS 3.341OC(=O)C(=C)O[P](O)(O)=O
ACDLabs 10.04O=C(O)C(\OP(=O)(O)O)=C
FormulaC3 H5 O6 P
NamePHOSPHOENOLPYRUVATE
ChEMBLCHEMBL1235228
DrugBankDB01819
ZINCZINC000003870145
PDB chain5hue Chain A Residue 502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5hue Inter-Enzyme Allosteric Regulation of Chorismate Mutase in Corynebacterium glutamicum: Structural Basis of Feedback Activation by Trp.
Resolution2.65 Å
Binding residue
(original residue number in PDB)		R136 E258 G292 E293 R294 K316 R347 H379
Binding residue
(residue number reindexed from 1)		R111 E233 G267 E268 R269 K291 R322 H354
Annotation score5
Enzymatic activity
Enzyme Commision number 2.5.1.54: 3-deoxy-7-phosphoheptulonate synthase.
Gene Ontology
Molecular Function
GO:0003849 3-deoxy-7-phosphoheptulonate synthase activity
GO:0016740 transferase activity
GO:0046872 metal ion binding
Biological Process
GO:0008652 amino acid biosynthetic process
GO:0009073 aromatic amino acid family biosynthetic process
GO:0009423 chorismate biosynthetic process

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Molecular Function
View graph for
Biological Process
External links
PDB RCSB:5hue, PDBe:5hue, PDBj:5hue
PDBsum5hue
PubMed29178787
UniProtQ8NNL5

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