Structure of PDB 4ppu Chain A Binding Site BS01

Receptor Information
>4ppu Chain A (length=245) Species: 3702 (Arabidopsis thaliana) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RVDESESLTLEGIRNSLIRQEDSIIFGLLERAKYCYNADTYDPTAFDMDG
FNGSLVEYMVKGTEKLHAKVGRFKSPDEHPFFPDDLPEPMLPPLQYPKVL
HFAADSININKKIWNMYFRDLVPRLVKKGDDGNYGSTAVCDAICLQCLSK
RIHYGKFVAEAKFQASPEAYESAIKAQDKDALMDMLTFPTVEDAIKKRVE
MKTRTYGQEVKVYKISPILVGDLYGDWIMPLTKEVQVEYLLRRLD
Ligand information
Ligand IDTYR
InChIInChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1
InChIKeyOUYCCCASQSFEME-QMMMGPOBSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)C(N)Cc1ccc(O)cc1
OpenEye OEToolkits 1.5.0c1cc(ccc1C[C@@H](C(=O)O)N)O
OpenEye OEToolkits 1.5.0c1cc(ccc1CC(C(=O)O)N)O
CACTVS 3.341N[CH](Cc1ccc(O)cc1)C(O)=O
CACTVS 3.341N[C@@H](Cc1ccc(O)cc1)C(O)=O
FormulaC9 H11 N O3
NameTYROSINE
ChEMBLCHEMBL925
DrugBankDB00135
ZINCZINC000000266964
PDB chain4ppu Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4ppu Structural evolution of differential amino Acid effector regulation in plant chorismate mutases.
Resolution2.3 Å
Binding residue
(original residue number in PDB)		R150 Y174
Binding residue
(residue number reindexed from 1)		R72 Y96
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) R92 R229 K240 F266 E270 T327 Q331
Catalytic site (residue number reindexed from 1) R14 R151 K162 F188 E192 T232 Q236
Enzyme Commision number 5.4.99.5: chorismate mutase.
Gene Ontology
Molecular Function
GO:0004106 chorismate mutase activity
Biological 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:4ppu, PDBe:4ppu, PDBj:4ppu
PDBsum4ppu
PubMed25160622
UniProtP42738|CM1_ARATH Chorismate mutase 1, chloroplastic (Gene Name=CM1)

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