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Ligand · DVL

DVL · 3-(1,3-benzothiazol-2-yl)-2-[[4-[(2~{S},3~{R},4~{S}, 5~{R},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl) oxan-2-yl]oxyphenyl]methoxy]-5-methyl-benzaldehyde

DVL, 3-(1,3-benzothiazol-2-yl)-2-[[4-[(2~{S},3~{R},4~{S}, 5~{R},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl) oxan-2-yl]oxyphenyl]methoxy]-5-methyl-benzaldehyde (C28 H27 N O8 S, 537.6 g/mol), in the MolNFT structures on GenesisL1: bound in…

Component
DVL
Formula
C28 H27 N O8 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

DVL in 2 structures; the first of them:

  • 6KUZ · E.coli beta-galactosidase (E537Q) in complex with fluorescent probe KSL01 · DVL A1101 · binds ASN102, ASP201, HIS391, HIS418, MET423, ASN460, GLU461, MET502 and 6 more
  • 6KUZ · E.COLI beta-galactosidase (E537Q) in complex with fluorescent probe KSL01 · DVL A1101 · binds ASN102, ASP201, HIS391, HIS418, MET423, ASN460, GLU461, MET502 and 6 more

Residues it binds most

ASN 8, HIS 8, TRP 8, GLU 8, MET 8, ASP 8, GLN 8, TYR 8, VAL 2 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • NA · Sodium ion
  • DMS · Dimethyl sulfoxide
  • GOL · Glycerol

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