Structure of PDB 1of6 Chain H Binding Site BS01

Receptor Information
>1of6 Chain H (length=347) Species: 4932 (Saccharomyces cerevisiae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GAEEDVRILGYDPLASPALLQVQIPATPTSLETAKRGRREAIDIITGKDD
RVLVIVGPCSIHDLEAAQEYALRLKKLSDELKGDLSIIMRAYLEKPRTTV
GWKGLINDPDVNNTFNINKGLQSARQLFVNLTNIGLPIGSEMLDTISPQY
LADLVSFGAIGARTTESQLHRELASGLSFPVGFKNGTDGTLNVAVDACQA
AAHSHHFMGVTKHGVAAITTTKGNEHCFVILRGGKKGTNYDAKSVAEAKA
QLPAGSNGLMIDYSHGNSNKDFRNQPKVNDVVCEQIANGENAITGVMIES
NINEGNQGIPAAGLKYGVSITDACIGWETTEDVLRKLAAAVRQRREV
Ligand information
Ligand IDDTY
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-/m1/s1
InChIKeyOUYCCCASQSFEME-MRVPVSSYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)C(N)Cc1ccc(O)cc1
CACTVS 3.341N[C@H](Cc1ccc(O)cc1)C(O)=O
OpenEye OEToolkits 1.5.0c1cc(ccc1CC(C(=O)O)N)O
CACTVS 3.341N[CH](Cc1ccc(O)cc1)C(O)=O
OpenEye OEToolkits 1.5.0c1cc(ccc1C[C@H](C(=O)O)N)O
FormulaC9 H11 N O3
NameD-TYROSINE
ChEMBLCHEMBL1076637
DrugBankDB03839
ZINCZINC000000002234
PDB chain1of6 Chain G Residue 1369 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1of6 Evolution of Feedback-Inhibited Beta /Alpha Barrel Isoenzymes by Gene Duplication and a Single Mutation.
Resolution2.1 Å
Binding residue
(original residue number in PDB)		E21 D22 I25
Binding residue
(residue number reindexed from 1)		E4 D5 I8
Annotation score1
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
Biological Process
GO:0008652 amino acid biosynthetic process
GO:0009058 biosynthetic process
GO:0009073 aromatic amino acid family biosynthetic process
GO:0009423 chorismate biosynthetic process
Cellular Component
GO:0005634 nucleus
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:1of6, PDBe:1of6, PDBj:1of6
PDBsum1of6
PubMed
UniProtP32449|AROG_YEAST Phospho-2-dehydro-3-deoxyheptonate aldolase, tyrosine-inhibited (Gene Name=ARO4)

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