Structure of PDB 8iub Chain A Binding Site BS01

Receptor Information
>8iub Chain A (length=546) Species: 376686 (Flavobacterium johnsoniae UW101) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KITLKTDKASYKPGETVNFTADKVFNSSLIRYTHLGKVIKEETFSGTSWS
WLPPSDDFQGYMVAIYQTNTDGTQTILGTVGIDVSSDWAKFPRYGFLSEF
GNISESDRAAVIDNLKDYHINGIQFYDWQYRQHQPLAGTVSNPMPVWNDI
INREVYGSTVSGYIAQAHSKNMKAMFYNLAYGVLNDYDPNLIKQQQFVYK
DANHNDKDKHELGWPFISNIYITDPANTAWQNYLAQKNDDVYKVYDFDGF
HIDQLGDRGNVFRYDGTNADLKNAFPSFISAMKSANTNKKLVMNAVNQYG
QKEIAGKELDFLYTEVWSPNEGFKDLTQVLTDNAAYSNNSKNTVLAAYMN
YNKANNQGMFNTPGVLLTDAVIFAFGGSHLELGEHMLGKEYFPNKNLSMS
AELKSSLLEYYDFMTAYQNLLRDGGTYTNPTIATGDGKLNLGSWPPTMGK
VAAVGKQVGSREIIHLLNFTNANSLNWRDTDGTQNVPDLIKQAMLNLNHS
GKVTKIWYASPDYNGGAAVELSFSQNGEKVNFKVPVLQYWAMIVVE
Ligand information
Ligand IDGLC
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-DVKNGEFBSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)O)O)O)O
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O
CACTVS 3.341OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
CACTVS 3.341OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O
ACDLabs 10.04OC1C(O)C(OC(O)C1O)CO
FormulaC6 H12 O6
Namealpha-D-glucopyranose;
alpha-D-glucose;
D-glucose;
glucose
ChEMBLCHEMBL423707
DrugBank
ZINCZINC000003861213
PDB chain8iub Chain B 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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PDB8iub Bacteroidota polysaccharide utilization system for branched dextran exopolysaccharides from lactic acid bacteria.
Resolution1.18 Å
Binding residue
(original residue number in PDB)		Y166 D167 Q172 Y217 L219 H250 L252 F256 I260 Y431
Binding residue
(residue number reindexed from 1)		Y126 D127 Q132 Y177 L179 H210 L212 F216 I220 Y391
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity

View graph for
Molecular Function
External links
PDB RCSB:8iub, PDBe:8iub, PDBj:8iub
PDBsum8iub
PubMed37269952
UniProtA5FBI2

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