Structure of PDB 6hjw Chain A Binding Site BS02

Receptor Information
>6hjw Chain A (length=240) Species: 4577 (Zea mays) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ERVDRSEILTLDSIRQVLIRLEDSIIFGLLERAQFCYNADTYDSNAFHMG
SLVEYMVRETEKLHAQVGRYKSPDEHPFFPEDLPEPRLPPMQYPRVLHPI
ADSININKEIWKMYFDELLPRLVKKGSDGNAGSSALCDTTCLQALSKRIH
YGKFVAEAKFQESPEAYMPAIIAQDRDQLMHLLTYETVERAIEHRVEAKA
KIFGQEVYKIVPSLVAELYSYRIMPLTKEVQIAYLLKRLD
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 chain6hjw Chain B Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6hjw A kiwellin disarms the metabolic activity of a secreted fungal virulence factor.
Resolution2.5 Å
Binding residue
(original residue number in PDB)		R79 V148 G149 R150
Binding residue
(residue number reindexed from 1)		R2 V67 G68 R69
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) R92 R229 K240 Y266 E270 T320 Q324
Catalytic site (residue number reindexed from 1) R15 R148 K159 Y185 E189 T227 Q231
Enzyme Commision number 5.4.99.5: chorismate mutase.
Gene Ontology
Molecular Function
GO:0004106 chorismate mutase activity
GO:0016853 isomerase activity
GO:0042803 protein homodimerization activity
Biological Process
GO:0008652 amino acid biosynthetic process
GO:0009073 aromatic amino acid family biosynthetic process
GO:0046417 chorismate metabolic process
Cellular Component
GO:0005737 cytoplasm
GO:0009507 chloroplast

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6hjw, PDBe:6hjw, PDBj:6hjw
PDBsum6hjw
PubMed30651637
UniProtB4FNK8|CM1_MAIZE Chorismate mutase 1, chloroplastic (Gene Name=CM1)

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