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Ligand · RYM

RYM · 4-(benzimidazol-1-ylmethyl)benzenecarbonitrile

RYM, 4-(benzimidazol-1-ylmethyl)benzenecarbonitrile (C15 H11 N3, 233.3 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (5 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
RYM
Formula
C15 H11 N3
Class
ligand
Structures
6
PDB entries
5

Binding sites

RYM in 6 structures; the first of them:

  • 5RME · PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 helicase in complex… · RYM B701 · binds GLU128, ARG129, LEU132, SER236, ALA237, PRO238, VAL241, ASN388
  • 7H7A · Group deposition for crystallographic fragment screening of Chikungunya virus nsP3… · RYM C206 · binds THR111, GLY112, SER115, GLY117, LYS118, ASP119, CYS143, ARG144 and 2 more
  • 5R54 · Pandda analysis group deposition -- crystal structure of human NUDT22 in complex with… · RYM A401 · binds LYS60, TYR87, PHE90, PRO120, GLU145, HIS156
  • 5RME · Pandda analysis group deposition -- crystal structure of SARS-cov-2 helicase in complex… · RYM B701 · binds GLU128, ARG129, SER236, ALA237, PRO238, ASN388
  • 7B8F · Notum-fragment 154 · RYM A509 · binds TRP128, TYR129, VAL187, THR236, PHE268, LEU269, ASP270, PRO287 and 3 more
  • 7QU3 · X-ray structure of FAD domain of nqrf of pseudomonas aeruginosa · RYM A502 · binds ARG229, GLY281, GLY309, ALA310, SER339, PHE353, ILE354, HIS355 and 3 more

Residues it binds most

PRO 5, ARG 4, GLY 2, PHE 3, SER 4, ALA 3, ASP 2, GLU 3, THR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide
  • ZN · Zinc ion
  • PO4 · Phosphate ion
  • FAD · Flavin-adenine dinucleotide
  • MG · Magnesium ion
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • CL · Chloride ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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