Ligand
Ligand Name:   4,5-EPOXYPENTYL-BETA-D-XYLOSIDE
Ligand Type:   D-saccharide
Ligand ID:   COVPDB611 PubChem:   5287872
Synonym(s):  
  •   3-[(2r)-oxiran-2-yl]propyl beta-d-xylopyranoside
  • q27458663
show 1 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL1231616
Canonical SMILES:   C1O[C@@H]1CCCO[C@H]2[C@H](O)[C@@H](O)[C@@H](CO2)O
Standard InChI:   InChI=1S/C10H18O6/c11-7-5-16-10(9(13)8(7)12)14-3-1-2-6-4-15-6/h6-13H,1-5H2/t6-,7-,8+,9-,10-/m1/s1
Molecular Formula:   C10H18O6 Mol. Weight:   234.11034 logP:   -1.379
HBD:   3 HBA:   6
#Rotatable Bonds:   5 TPSA:   91.68

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Endo-1,4-beta-xylanase 2 P36217 (XYN2_HYPJR) Hypocrea jecorina (strain ATCC 56765 / BCRC 32924 / NRRL 11460 / Rut C-30) (Trichoderma reesei) 1RED C5X
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