Structure of PDB 1rxc Chain B Binding Site BS03
Receptor Information
>1rxc Chain B (length=250) Species:
562
(Escherichia coli) [
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SDVFHLGLTKNDLQGATLAIVPGDPDRVEKIAALMDKPVKLASHREFTTW
RAELDGKPVIVCSTGIGGPSTSIAVEELAQLGIRTFLRIGTTGAIQPHIN
VGDVLVTTASVRLDGASLHFAPLEFPAVADFECTTALVEAAKSIGATTHV
GVTASSDTFYPGQERYDTYSGRVVRHFKGSMEEWQAMGVMNYEMESATLL
TMCASQGLRAGMVAGVIVNRTQQEIPNAETMKQTESHAVKIVVEAARRLL
Ligand information
Ligand ID
URF
InChI
InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
InChIKey
GHASVSINZRGABV-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
C1=C(C(=O)NC(=O)N1)F
ACDLabs 10.04
CACTVS 3.341
FC1=CNC(=O)NC1=O
Formula
C4 H3 F N2 O2
Name
5-FLUOROURACIL
ChEMBL
CHEMBL185
DrugBank
DB00544
ZINC
ZINC000038212689
PDB chain
1rxc Chain B Residue 2011 [
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Receptor-Ligand Complex Structure
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PDB
1rxc
Crystal structures of escherichia coli uridine phosphorylase in two native and three complexed forms reveal basis of substrate specificity, induced conformational changes and influence of potassium
Resolution
2.35 Å
Binding residue
(original residue number in PDB)
T94 T95 G96 F162 Q166 I220 V221
Binding residue
(residue number reindexed from 1)
T91 T92 G93 F159 Q163 I217 V218
Annotation score
1
Enzymatic activity
Catalytic site (original residue number in PDB)
H8 G26 R30 R48 E80 R91 T94 R168 I220 V221 R223 M234
Catalytic site (residue number reindexed from 1)
H5 G23 R27 R45 E77 R88 T91 R165 I217 V218 R220 M231
Enzyme Commision number
2.4.2.3
: uridine phosphorylase.
Gene Ontology
Molecular Function
GO:0003824
catalytic activity
GO:0004850
uridine phosphorylase activity
GO:0005524
ATP binding
GO:0016757
glycosyltransferase activity
GO:0016763
pentosyltransferase activity
GO:0030955
potassium ion binding
GO:0042802
identical protein binding
GO:0047847
deoxyuridine phosphorylase activity
Biological Process
GO:0006218
uridine catabolic process
GO:0006974
DNA damage response
GO:0009116
nucleoside metabolic process
GO:0009164
nucleoside catabolic process
GO:0009166
nucleotide catabolic process
GO:0044206
UMP salvage
GO:0046050
UMP catabolic process
Cellular Component
GO:0005737
cytoplasm
GO:0005829
cytosol
GO:0032991
protein-containing complex
View graph for
Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:1rxc
,
PDBe:1rxc
,
PDBj:1rxc
PDBsum
1rxc
PubMed
15003451
UniProt
P12758
|UDP_ECOLI Uridine phosphorylase (Gene Name=udp)
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