Structure of PDB 1ofo Chain B Binding Site BS01
Receptor Information
>1ofo Chain B (length=339) Species:
4932
(Saccharomyces cerevisiae) [
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VRILGYDPLASPALLQVQIPATPTSLETAKRGRREAIDIITGKDDRVLVI
VGPCSIHDLEAAQEYALRLKKLSDELKGDLSIIMRAYLEKPRTTVGWKGL
INDPDVNNTFNINKGLQSARQLFVNLTNIGLPIGSEMLDTISPQYLADLV
SFGAIGARTTESQLHRELASGLSFPVGFKNGTDGTLNVAVDACQAAAHSH
HFMGVTKHGVAAITTTKGNEHCFVILRGGKKGTNYDAKSVAEAKAQLPAG
SNGLMIDYSHGNSNKDFRNQPKVNDVVCEQIANGENAITGVMIESNINEG
NQGIKYGVSITDACIGWETTEDVLRKLAAAVRQRREVNK
Ligand information
Ligand ID
PGA
InChI
InChI=1S/C2H5O6P/c3-2(4)1-8-9(5,6)7/h1H2,(H,3,4)(H2,5,6,7)
InChIKey
ASCFNMCAHFUBCO-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
OC(=O)CO[P](O)(O)=O
OpenEye OEToolkits 1.5.0
C(C(=O)O)OP(=O)(O)O
ACDLabs 10.04
O=P(O)(O)OCC(=O)O
Formula
C2 H5 O6 P
Name
2-PHOSPHOGLYCOLIC ACID
ChEMBL
CHEMBL47181
DrugBank
DB02726
ZINC
ZINC000003869735
PDB chain
1ofo Chain B Residue 442 [
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Receptor-Ligand Complex Structure
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PDB
1ofo
Substrate and Metal Complexes of 3-Deoxy-D-Arabino-Heptulosonate-7-Phosphate Synthase from Saccharomyces Cerevisiae Provide New Insights Into the Catalytic Mechanism.
Resolution
1.86 Å
Binding residue
(original residue number in PDB)
R107 G178 K201 R249 H282
Binding residue
(residue number reindexed from 1)
R85 G156 K179 R227 H260
Annotation score
1
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:1ofo
,
PDBe:1ofo
,
PDBj:1ofo
PDBsum
1ofo
PubMed
15019786
UniProt
P32449
|AROG_YEAST Phospho-2-dehydro-3-deoxyheptonate aldolase, tyrosine-inhibited (Gene Name=ARO4)
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