Structure of PDB 7x0n Chain B Binding Site BS01

Receptor Information
>7x0n Chain B (length=409) Species: 1515 (Acetivibrio thermocellus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SVKLTMWIMPNSDTPDQDLLKVVKPFTDANPHITVEPTVVDWSAALTKIT
AAATSGEAPDITQVGSTWTAAIGAMEGALVELTGKIDTSAFVESTLQSAY
IKGTDKMFGMPWFTETRALFYRKDACEKAGVNPETDFATWDKFKDALKKL
NGIEVDGKKLAALGMPGKNDWNVVHNFSWWIYGAGGDFVNEEGTQATFSS
ENALKGIKFYSELAVEGLMDEPSLEKNTSDIESAFGDGAYATAFMGPWVI
SSYTKNKEENGNDLIDKIGVTMVPEGPAGRYAFMGGSNLVIFNSSKNKDE
ALELLKFFASKEAQVEYSKVSKMLPVVKAAYEDPYFEDSLMKVFKEQVDK
YGKHYASVPGWASAEVIFSEGLSKIWDNVMEVDGAYSYDKTVQIVKDVES
QINQILQET
Ligand information
Ligand IDBGC
InChIInChI=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
InChIKeyWQZGKKKJIJFFOK-VFUOTHLCSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.6C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.370OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O
CACTVS 3.370OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
OpenEye OEToolkits 1.7.6C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O
ACDLabs 12.01OC1C(O)C(OC(O)C1O)CO
FormulaC6 H12 O6
Namebeta-D-glucopyranose;
beta-D-glucose;
D-glucose;
glucose
ChEMBLCHEMBL1614854
DrugBankDB02379
ZINCZINC000003833800
PDB chain7x0n Chain D Residue 1 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7x0n Deciphering Cellodextrin and Glucose Uptake in Clostridium thermocellum.
Resolution1.68 Å
Binding residue
(original residue number in PDB)		N59 W90 E163 R165 W219 N220 W296
Binding residue
(residue number reindexed from 1)		N11 W42 E115 R117 W171 N172 W248
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:1901982 maltose binding
Biological Process
GO:0015768 maltose transport
GO:0042956 maltodextrin transmembrane transport
Cellular Component
GO:0055052 ATP-binding cassette (ABC) transporter complex, substrate-binding subunit-containing

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7x0n, PDBe:7x0n, PDBj:7x0n
PDBsum7x0n
PubMed36069444
UniProtA3DE73

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