Structure of PDB 5fu3 Chain B Binding Site BS01
Receptor Information
>5fu3 Chain B (length=99) Species:
1265
(Ruminococcus flavefaciens) [
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TAILYPFTISGNDRNGNFTINFKGTPNSTNNGCIGYSYNGDWEKIEWEGS
CDGNGNLVVEVPMSKIPAGVTSGEIQIWWHSGDLKMTDYKALEHHHHHH
Ligand information
Ligand ID
BGC
InChI
InChI=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
InChIKey
WQZGKKKJIJFFOK-VFUOTHLCSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.6
C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.370
OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O
CACTVS 3.370
OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
OpenEye OEToolkits 1.7.6
C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O
ACDLabs 12.01
OC1C(O)C(OC(O)C1O)CO
Formula
C6 H12 O6
Name
beta-D-glucopyranose;
beta-D-glucose;
D-glucose;
glucose
ChEMBL
CHEMBL1614854
DrugBank
DB02379
ZINC
ZINC000003833800
PDB chain
5fu3 Chain D Residue 1 [
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Receptor-Ligand Complex Structure
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PDB
5fu3
Complexity of the Ruminococcus Flavefaciens Cellulosome Reflects an Expansion in Glycan Recognition.
Resolution
1.61 Å
Binding residue
(original residue number in PDB)
W453 E485 Q487
Binding residue
(residue number reindexed from 1)
W42 E74 Q76
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0046872
metal ion binding
View graph for
Molecular Function
External links
PDB
RCSB:5fu3
,
PDBe:5fu3
,
PDBj:5fu3
PDBsum
5fu3
PubMed
27298375
UniProt
A0A1A9TAF4
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