Structure of PDB 5c65 Chain A Binding Site BS03
Receptor Information
>5c65 Chain A (length=457) Species:
9606
(Homo sapiens) [
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KVTPALIFAITVATIGSFQFGYNTGVINAPEKIIKEFIQKTLTDKGNAPP
SEVLLTSLWSLSVAIFSVGGMIGSFSVGLFVNRFGRRNSMLIVNLLAVTG
GCFMGLCKVAKSVEMLILGRLVIGLFCGLCTGFVPMYIGEISPTALRGAF
GTLNQLGIVVGILVAQIFGLEFILGSEELWPLLLGFTILPAILQSAALPF
CPESPRFLLINRKEEENAKQILQRLWGTQDVSQDIQEMKDESARMSQEKQ
VTVLELFRVSSYRQPIIISIVLQLSQQLSGINAVFYYSTGIFKDAPIYAT
IGAGVVNTIFTVVSLFLVERAGRRTLHMIGLGGMAFCSTLMTVSLLLKDM
SFVCIGAILVFVAFFEIGPGPIPWFIVAELFSQGPRPAAMAVAGCSNWTS
NFLVGLLFPSAAHYLGAYVFIIFTGFLITFLAFTFFKVPETRGRTFEDIT
RAFEGQA
Ligand information
Ligand ID
37X
InChI
InChI=1S/C27H52O12/c1-3-5-7-9-11-27(12-10-8-6-4-2,15-36-25-23(34)21(32)19(30)17(13-28)38-25)16-37-26-24(35)22(33)20(31)18(14-29)39-26/h17-26,28-35H,3-16H2,1-2H3/t17-,18-,19-,20-,21+,22+,23-,24-,25-,26-/m0/s1
InChIKey
TYXCLOLHZMMLEK-RNDJEAJNSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.9.2
CCCCCCC(CCCCCC)(COC1C(C(C(C(O1)CO)O)O)O)COC2C(C(C(C(O2)CO)O)O)O
ACDLabs 12.01
O(CC(CCCCCC)(CCCCCC)COC1OC(CO)C(O)C(O)C1O)C2OC(C(O)C(O)C2O)CO
OpenEye OEToolkits 1.9.2
CCCCCCC(CCCCCC)(CO[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)CO)O)O)O)CO[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)CO)O)O)O
CACTVS 3.385
CCCCCCC(CCCCCC)(CO[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O)CO[CH]2O[CH](CO)[CH](O)[CH](O)[CH]2O
CACTVS 3.385
CCCCCCC(CCCCCC)(CO[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O)CO[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O
Formula
C27 H52 O12
Name
Octyl Glucose Neopentyl Glycol
ChEMBL
DrugBank
ZINC
ZINC000098208404
PDB chain
5c65 Chain A Residue 506 [
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Receptor-Ligand Complex Structure
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PDB
5c65
Structure of the human glucose transporter GLUT3 / SLC2A3
Resolution
2.65 Å
Binding residue
(original residue number in PDB)
L46 L62
Binding residue
(residue number reindexed from 1)
L42 L58
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0005353
fructose transmembrane transporter activity
GO:0005354
galactose transmembrane transporter activity
GO:0005515
protein binding
GO:0005536
D-glucose binding
GO:0022857
transmembrane transporter activity
GO:0033300
dehydroascorbic acid transmembrane transporter activity
GO:0055056
D-glucose transmembrane transporter activity
Biological Process
GO:0005975
carbohydrate metabolic process
GO:0015755
fructose transmembrane transport
GO:0015757
galactose transmembrane transport
GO:0019852
L-ascorbic acid metabolic process
GO:0046323
D-glucose import
GO:0055085
transmembrane transport
GO:0070837
dehydroascorbic acid transport
GO:0098708
D-glucose import across plasma membrane
GO:0150104
transport across blood-brain barrier
GO:1904659
D-glucose transmembrane transport
Cellular Component
GO:0005886
plasma membrane
GO:0016020
membrane
GO:0016235
aggresome
GO:0030667
secretory granule membrane
GO:0035579
specific granule membrane
GO:0042995
cell projection
GO:0043204
perikaryon
GO:0070062
extracellular exosome
GO:0070821
tertiary granule membrane
GO:0101003
ficolin-1-rich granule membrane
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:5c65
,
PDBe:5c65
,
PDBj:5c65
PDBsum
5c65
PubMed
UniProt
P11169
|GTR3_HUMAN Solute carrier family 2, facilitated glucose transporter member 3 (Gene Name=SLC2A3)
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