Structure of PDB 5gm4 Chain B Binding Site BS04

Receptor Information
>5gm4 Chain B (length=218) Species: 5053 (Aspergillus aculeatus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QLCDQYATYTGGVYTINNNLWGKDAGSGSQCTTVNSASSAGTSWSTKWNW
SGGENSVKSYANSGLTFNKKLVSQISQIPTTARWSYDNTGIRADVAYDLF
TAADINHVTWSGDYELMIWLARYGGVQPIGSQIATATVDGQTWELWYGAN
GSQKTYSFVAPTPITSFQGDVNDFFKYLTQNHGFPASSQYLITLQFGTAP
FTGGPATLSVSNWSASVQ
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 chain5gm4 Chain J Residue 4 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5gm4 Crystal structure and genetic modifications of FI-CMCase from Aspergillus aculeatus F-50
Resolution1.92 Å
Binding residue
(original residue number in PDB)		Q135 I136
Binding residue
(residue number reindexed from 1)		Q132 I133
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) E118 A202
Catalytic site (residue number reindexed from 1) E115 A199
Enzyme Commision number 3.2.1.4: cellulase.
Gene Ontology
Molecular Function
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0008810 cellulase activity
GO:0016798 hydrolase activity, acting on glycosyl bonds
Biological Process
GO:0000272 polysaccharide catabolic process
GO:0030245 cellulose catabolic process
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:5gm4, PDBe:5gm4, PDBj:5gm4
PDBsum5gm4
PubMed27470581
UniProtP22669|GUN_ASPAC Endoglucanase-1

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