Structure of PDB 6rw3 Chain B Binding Site BS01
Receptor Information
>6rw3 Chain B (length=439) Species:
5833
(Plasmodium falciparum) [
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FFSTSFKYVLSACIASFIFGYQVSVLNTIKNFIVVEFECSNNTIQSSFLL
ASVFIGAVLGCGFSGYLVQFGRRLSLLIIYNFFFLVSILTSITHHFHTIL
FARLLSGFGIGLVTVSVPMYISEMTHKDKKGAYGVMHQLFITFGIFVAVM
LGLAMGEGPKTSFAKLWWRLMFLFPSVISLIGILALVVFFKEETPYFLFE
KGRIEESKNILKKIYETDNVDEPLNAIKEAVEQNESAKKNSLSLLSALKI
PSYRYVIILGCLLSGLQQFTGINVLVSNSNELYKEFLDSHLITILSVVMT
AVNFLMTFPAIYIVEKLGRKTLLLWGCVGVLVAYLPTAIANEINNFVKIL
SIVATFVMIISFAVSYGPVLWIYLHEMFPSEIKDSAASLASLVNWVCAII
VVFPSDIIIKKSPSILFIVFSVMSILTFFFIFFFIKETK
Ligand information
Ligand ID
GLC
InChI
InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1
InChIKey
WQZGKKKJIJFFOK-DVKNGEFBSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
C(C1C(C(C(C(O1)O)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)O
CACTVS 3.341
OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
CACTVS 3.341
OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O
ACDLabs 10.04
OC1C(O)C(OC(O)C1O)CO
Formula
C6 H12 O6
Name
alpha-D-glucopyranose;
alpha-D-glucose;
D-glucose;
glucose
ChEMBL
CHEMBL423707
DrugBank
ZINC
ZINC000003861213
PDB chain
6rw3 Chain B Residue 601 [
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Receptor-Ligand Complex Structure
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PDB
6rw3
The molecular basis for sugar import in malaria parasites.
Resolution
3.65 Å
Binding residue
(original residue number in PDB)
Q169 Q305 I310 N311 Y407 W412
Binding residue
(residue number reindexed from 1)
Q138 Q267 I272 N273 Y366 W371
Annotation score
5
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0015149
hexose transmembrane transporter activity
GO:0022857
transmembrane transporter activity
Biological Process
GO:0008645
hexose transmembrane transport
GO:0015749
monosaccharide transmembrane transport
GO:0055085
transmembrane transport
Cellular Component
GO:0005886
plasma membrane
GO:0016020
membrane
View graph for
Molecular Function
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Biological Process
View graph for
Cellular Component
External links
PDB
RCSB:6rw3
,
PDBe:6rw3
,
PDBj:6rw3
PDBsum
6rw3
PubMed
31996846
UniProt
O97467
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