Structure of PDB 7xoi Chain C Binding Site BS01

Receptor Information
>7xoi Chain C (length=465) Species: 927772 (Aspergillus sojae NBRC 4239) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PGDDLYVKDLSGCPGYKATKHWQTRSGFYADLTLAGPACNVFGTDLPDLK
LEVEYQTSDRLHVKILDTNNTVYQVPDSVFPRPGFGEWCSPKDSKLKFDF
QADPFSFTVSRTDTGEVLFDTTGNKLVFESQYVYLKTHLPQNPHLYGLGE
HSDAFMLNTTNYTRTIYTRDAYGTPQGENLYGAHPIYFDHRQTGTHGVFL
LNSNGMDIFIDNNATQYLEYNIIGGVLDFYFIAGPSPRDVAIQYAEITQT
PLMTPYWGLGYHQCKYGYQDVYEVAAVVANYSTNNIPLETIWTDIDYMDR
RRIFTIDPERFPANLYKDLVDTIHARDQHYIVMVDPAVYYKESNPALDEG
LRYDIFMKENNGSEYQGVVWAGPSHFPDWFHPDSQQYWSEQFLAFFDGTN
GPDIDALWIDMNEPANFYNRPYPGNNTTPENFAEVDGDPPAAPAVRDGPD
APIPGFPASLQPNWV
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 chain7xoi Chain U Residue 1 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7xoi Structural basis for proteolytic processing of Aspergillus sojae alpha-glucosidase L with strong transglucosylation activity.
Resolution2.3 Å
Binding residue
(original residue number in PDB)		Y296 D324 W400 D440 M441
Binding residue
(residue number reindexed from 1)		Y266 D294 W370 D410 M411
Annotation score4
Enzymatic activity
Enzyme Commision number 3.2.1.20: alpha-glucosidase.
3.2.1.21: beta-glucosidase.
Gene Ontology
Molecular Function
GO:0003824 catalytic activity
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0030246 carbohydrate binding
Biological Process
GO:0005975 carbohydrate metabolic process
GO:0007618 mating
Cellular Component
GO:0005576 extracellular region

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7xoi, PDBe:7xoi, PDBj:7xoi
PDBsum7xoi
PubMed35688347
UniProtA0A5N6DPG0

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