Structure of PDB 6x9m Chain A Binding Site BS05

Receptor Information
>6x9m Chain A (length=182) Species: 178399 (Marinomonas primoryensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PDSLFAGLVGEYYGTNSQLNNISDFRALVDSKEADATFEAANISYGRGSS
DVAKGTHLQEFLGSDASTLSTDPGDNTDGGIYLQGYVYLEAGTYNFKVTA
DDGYEITINGNPVATVDNNQSVYTVTHASFTISESGYQAIDMIWWDQGGD
YVFQPTLSADGGSTYFVLDSAILSSTGETPYT
Ligand information
Ligand ID3MG
InChIInChI=1S/C7H14O6/c1-12-6-4(9)3(2-8)13-7(11)5(6)10/h3-11H,2H2,1H3/t3-,4-,5-,6+,7-/m1/s1
InChIKeySCBBSJMAPKXHAH-BNWJMWRWSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0COC1C(C(OC(C1O)O)CO)O
CACTVS 3.341CO[CH]1[CH](O)[CH](O)O[CH](CO)[CH]1O
ACDLabs 10.04O(C1C(O)C(OC(O)C1O)CO)C
OpenEye OEToolkits 1.5.0CO[C@H]1[C@@H]([C@H](O[C@H]([C@@H]1O)O)CO)O
CACTVS 3.341CO[C@@H]1[C@@H](O)[C@H](O)O[C@H](CO)[C@H]1O
FormulaC7 H14 O6
Name3-O-methyl-beta-D-glucopyranose;
3-O-methyl-beta-D-glucose;
3-O-methyl-D-glucose;
3-O-methyl-glucose
ChEMBL
DrugBank
ZINCZINC000003861773
PDB chain6x9m Chain A Residue 1007 [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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PDB6x9m Structural Basis of Ligand Selectivity by a Bacterial Adhesin Lectin Involved in Multispecies Biofilm Formation.
Resolution1.0 Å
Binding residue
(original residue number in PDB)		D110 D111 Q156 G157 G158 D159
Binding residue
(residue number reindexed from 1)		D101 D102 Q147 G148 G149 D150
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links