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Ligand · STV

STV · ~{N}-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide

STV, ~{N}-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide (C10 H13 N O4 S, 243.3 g/mol), in the MolNFT structures on GenesisL1: bound in 7 records (5 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
STV
Formula
C10 H13 N O4 S
Class
ligand
Structures
7
PDB entries
5

Binding sites

STV in 7 structures; the first of them:

  • 5R9W · PanDDA analysis group deposition Form1 MAP kinase p38-alpha -- Fragment N13598a in… · STV A401 · binds VAL38, ALA51, VAL52, LYS53, GLU71, LEU74, LEU75, ILE84 and 7 more
  • 5S5W · Tubulin-Z53860899-complex · STV B505 · binds LYS176, VAL177, SER178, ASP179, TYR210, THR221, PRO222, TYR224 and 1 more
  • 7GP9 · PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3C Protease in… · STV A201 · binds HIS40, GLU71, LEU127, GLY128, THR130, CYS147, VAL162, GLY163 and 1 more
  • 7H3A · Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A… · STV A201 · binds THR60, PRO73, VAL74, SER75
  • 5R9W · Pandda analysis group deposition FORM1 MAP kinase P38-alpha -- fragment N13598A in… · STV A401 · binds ALA51, LYS53, GLU71, LEU75, LEU104, THR106, ASP168, PHE169 and 1 more
  • 5RMI · Pandda analysis group deposition -- crystal structure of SARS-cov-2 helicase in complex… · STV A701 · binds ARG303, THR351, LEU352, THR366, THR367, ILE20, ARG21, PRO234
  • 5S5W · Tubulin-Z53860899-complex · STV B505 · binds LYS176, VAL177, SER178, ASP179, TYR210, THR221, PRO222, TYR224 and 1 more

Residues it binds most

LEU 7, VAL 8, THR 9, PRO 7, ILE 4, SER 4, GLU 4, GLY 2, ALA 4, ASN 4 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • DMS · Dimethyl sulfoxide
  • ACP · Phosphomethylphosphonic acid adenylate ester
  • GDP · Guanosine-5'-diphosphate
  • GTP · Guanosine-5'-triphosphate
  • CA · Calcium ion
  • ZN · Zinc ion
  • CL · Chloride ion
  • SO4 · Sulfate ion
  • MES · 2-(N-morpholino)-ethanesulfonic acid
  • PO4 · Phosphate ion

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