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Ligand · RWS

RWS · 1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine

RWS, 1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine (C8 H13 N3 S, 183.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
RWS
Formula
C8 H13 N3 S
Class
ligand
Structures
4
PDB entries
3

Binding sites

RWS in 4 structures; the first of them:

  • 5S51 · Tubulin-Z1251207602-complex · RWS B505 · binds TYR202, VAL238, CYS241, LEU255, MET259, ALA316, ALA317, ILE318 and 4 more
  • 7HNL · PanDDA analysis group deposition -- Crystal Structure of TRIM21 in complex with… · RWS B202 · binds ASP48, ASN49, LYS50
  • 5R5T · Pandda analysis group deposition -- crystal structure of fibrinogen- like globe domain of… · RWS A2401 · binds ASP2019, ARG2073, PHE2084, ARG2192
  • 5S51 · Tubulin-Z1251207602-complex · RWS B505 · binds TYR202, VAL238, CYS241, LEU255, ALA316, ALA317, ILE318, LYS352 and 2 more

Residues it binds most

ALA 4, LYS 5, ASN 3, VAL 4, LEU 4, ILE 2, THR 3, MET 3, ARG 1, ASP 2 (residue and the binding sites it lines).

Found with

  • ACP · Phosphomethylphosphonic acid adenylate ester
  • GDP · Guanosine-5'-diphosphate
  • GTP · Guanosine-5'-triphosphate
  • CA · Calcium ion
  • MG · Magnesium ion
  • MES · 2-(N-morpholino)-ethanesulfonic acid
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid

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