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Ligand · DTO

DTO · 1-hydroxysulfanyl-4-mercapto-butane-2,3-diol

DTO, 1-hydroxysulfanyl-4-mercapto-butane-2,3-diol (C4 H10 O3 S2, 170.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
DTO
Formula
C4 H10 O3 S2
Class
ligand
Structures
4
PDB entries
2

Binding sites

DTO in 4 structures; the first of them:

  • 1QMH · Crystal structure of RNA 3'-terminal phosphate cyclase, an ubiquitous enzyme with unusual… · DTO B402 · binds VAL201, PRO233, GLY234, ASN235, GLY254, GLU255, LYS256, VAL258 and 1 more
  • 4G61 · Crystal structure of IMPase/NADP phosphatase complexed with Mg2+ and phosphate · DTO B307 · binds GLU101, ASP102, HIS125, LYS127, ARG191, GLU101, ASP102, HIS125 and 2 more
  • 1QMH · Crystal structure of RNA 3'-terminal phosphate cyclase, an ubiquitous enzyme with unusual… · DTO B402 · binds VAL201, PRO233, GLY234, ASN235, GLY254, GLU255, LYS256, VAL258 and 1 more
  • 4G61 · Crystal structure of IMPASE/NADP phosphatase complexed with MG2+ and phosphate · DTO B307 · binds GLU101, ASP102, HIS125, LYS127, ARG191, GLU101, ASP102, HIS125 and 2 more

Residues it binds most

VAL 4, GLU 4, ARG 2, ASP 2, GLY 2, HIS 2, LYS 4, ASN 2, PRO 2 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • CL · Chloride ion
  • PO4 · Phosphate ion
  • CIT · Citric acid
  • GOL · Glycerol
  • P33 · 3,6,9,12,15,18-hexaoxaicosane-1,20-diol
  • PG4 · Tetraethylene glycol

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