Structure of PDB 7ded Chain C Binding Site BS01

Receptor Information
>7ded Chain C (length=140) Species: 456320 (Methanococcus voltae A3) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DNYIYSTEVGGVGGTPFTFMQESGTITSIKFNWSDQYKLLHHIEVKFINN
ANIYATGDPKGNHEVILEIDDDETIIGSVIGYKKGNDGRCTGVKLTTSKG
KSIMAGYFEESLITTYTGKLAGIKGGAGSDIDRLGLIFLK
Ligand information
Ligand IDMAN
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-PQMKYFCFSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(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
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O)O)O)O
ACDLabs 10.04OC1C(O)C(OC(O)C1O)CO
FormulaC6 H12 O6
Namealpha-D-mannopyranose;
alpha-D-mannose;
D-mannose;
mannose
ChEMBLCHEMBL365590
DrugBank
ZINCZINC000003860903
PDB chain7ded Chain I Residue 6 [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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PDB7ded Mevo lectin specificity toward high-mannose structures with terminal alpha Man(1,2) alpha Man residues and its implication to inhibition of the entry of Mycobacterium tuberculosis into macrophages.
Resolution2.228 Å
Binding residue
(original residue number in PDB)		G17 G18 R93 G132 S133 D134 D136
Binding residue
(residue number reindexed from 1)		G13 G14 R89 G128 S129 D130 D132
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links