Structure of PDB 7bt9 Chain C Binding Site BS01
Receptor Information
>7bt9 Chain C (length=140) Species:
456320
(Methanococcus voltae A3) [
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DNYIYSTEVGGVGGTPFTFMQESGTITSIKFNWSDQYKLLHHIEVKFINN
ANIYATGDPKGNHEVILEIDDDETIIGSVIGYKKGNDGRCTGVKLTTSKG
KSIMAGYFEESLITTYTGKLAGIKGGAGSDIDRLGLIFLK
Ligand information
Ligand ID
MAN
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-PQMKYFCFSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.341
OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
CACTVS 3.341
OC[C@H]1O[C@H](O)[C@@H](O)[C@@H](O)[C@@H]1O
OpenEye OEToolkits 1.5.0
C([C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O)O)O)O
ACDLabs 10.04
OC1C(O)C(OC(O)C1O)CO
Formula
C6 H12 O6
Name
alpha-D-mannopyranose;
alpha-D-mannose;
D-mannose;
mannose
ChEMBL
CHEMBL365590
DrugBank
ZINC
ZINC000003860903
PDB chain
7bt9 Chain C Residue 201 [
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Receptor-Ligand Complex Structure
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PDB
7bt9
Structural and related studies on Mevo lectin from Methanococcus voltae A3: the first thorough characterization of an archeal lectin and its interactions.
Resolution
2.45 Å
Binding residue
(original residue number in PDB)
G18 R93 G132 S133 D134 D136
Binding residue
(residue number reindexed from 1)
G14 R89 G128 S129 D130 D132
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:7bt9
,
PDBe:7bt9
,
PDBj:7bt9
PDBsum
7bt9
PubMed
32651948
UniProt
D7DTD6
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