Structure of PDB 3tfc Chain A Binding Site BS02

Receptor Information
>3tfc Chain A (length=343) Species: 169963 (Listeria monocytogenes EGD-e) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LRTQVDQLNIDLLELISKRANLVQEIGKIKLRFDPLREREMLNTILAANE
GPFEDSTVQKLFKEIFKAGLELQEEDHSKALLVSRKNKKEDTIVTVKGLP
IGNGEPVFVFGPCSVESYEQVAAVAESIKAKGLKLIRGGAFKPRTSPYDF
QGLGLEGLKILKRVSDEYGLGVISEIVTPADIEVALDYVDVIQIGARNMQ
NFELLKAAGRVDKPILLKRGLSATIEEFIGAAEYIMSQGNGKIILCERGI
RTYEKATRNTLDISAVPILKKETHLPVMVDVTHSTGRKDLLLPCAKAALA
IEADGVMAEVHPDPAVALSDSAQQMDIPEFEEFWNAILASNLV
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 chain3tfc Chain A Residue 1268 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3tfc Structural analysis of a 3-deoxy-D-arabino-heptulosonate 7-phosphate synthase with an N-terminal chorismate mutase-like regulatory domain.
Resolution1.95 Å
Binding residue
(original residue number in PDB)		R150 Q206 A209 K231 R261 H296
Binding residue
(residue number reindexed from 1)		R137 Q193 A196 K218 R248 H283
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016832 aldehyde-lyase activity
GO:0046872 metal ion binding
Biological Process
GO:0009058 biosynthetic process
GO:0009073 aromatic amino acid family biosynthetic process
GO:0046417 chorismate metabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:3tfc, PDBe:3tfc, PDBj:3tfc
PDBsum3tfc
PubMed22505283
UniProtQ8Y6T2

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