Structure of PDB 1ofz Chain A Binding Site BS04
Receptor Information
>1ofz Chain A (length=312) Species:
5188
(Aleuria aurantia) [
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PTEFLYTSKIAAISWAATGGRQQRVYFQDLNGKIREAQRGGDNPWTGGSS
QNVIGEAKLFSPLAAVTWKSAQGIQIRVYCVNKDNILSEFVYDGSKWITG
QLGSVGVKVGSNSKLAALQWGGSESAPPNIRVYYQKSNLSGSSIHEYVWS
GKWTAGASFGSTAPGTGIGATAIGPGRLRIYYQATDNKIREHCWDSNSWY
VGGFSASASAGVSIAAISWGSTPNIRVYWQKGREELYEAAYGGSWNTPGQ
IKDASRPTPSLPDTFIAANSSGNIDISVFFQASGVSLQQWQWISGKGWSI
GAVVPTGTPAGW
Ligand information
Ligand ID
FUC
InChI
InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6+/m0/s1
InChIKey
SHZGCJCMOBCMKK-SXUWKVJYSA-N
SMILES
Software
SMILES
CACTVS 3.341
C[C@@H]1O[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1O
ACDLabs 10.04
OC1C(O)C(OC(O)C1O)C
OpenEye OEToolkits 1.5.0
CC1C(C(C(C(O1)O)O)O)O
OpenEye OEToolkits 1.5.0
C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O)O)O)O
CACTVS 3.341
C[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
Formula
C6 H12 O5
Name
alpha-L-fucopyranose;
alpha-L-fucose;
6-deoxy-alpha-L-galactopyranose;
L-fucose;
fucose
ChEMBL
CHEMBL1232862
DrugBank
DB04473
ZINC
ZINC000001532814
PDB chain
1ofz Chain A Residue 1316 [
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Receptor-Ligand Complex Structure
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PDB
1ofz
Crystal Structure of Fungal Lectin: Six-Bladed {Beta}-Propeller Fold and Novel Fucose Recognition Mode for Aleuria Aurantia Lectin
Resolution
1.5 Å
Binding residue
(original residue number in PDB)
R179 E191 G202 G203 Y241
Binding residue
(residue number reindexed from 1)
R179 E191 G202 G203 Y241
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0030246
carbohydrate binding
GO:0042802
identical protein binding
GO:0042803
protein homodimerization activity
GO:0042806
fucose binding
Biological Process
GO:0030582
reproductive fruiting body development
GO:0050832
defense response to fungus
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Molecular Function
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Biological Process
External links
PDB
RCSB:1ofz
,
PDBe:1ofz
,
PDBj:1ofz
PDBsum
1ofz
PubMed
12732625
UniProt
P18891
|LECF_ALEAU Fucose-specific lectin
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