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Ligand · T0W

T0W · 2-(benzotriazol-1-yl)-~{N}-ethyl-~{N}-(furan-3-ylmethyl)ethanamide

T0W, 2-(benzotriazol-1-yl)-~{N}-ethyl-~{N}-(furan-3-ylmethyl)ethanamide (C15 H16 N4 O2, 284.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues…

Component
T0W
Formula
C15 H16 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

T0W in 2 structures; the first of them:

  • 7B77 · Crystal Structure of SARS-CoV-2 main protease (Nsp5) in complex with compound 8 · T0W A405 · binds HIS41, MET49, TYR54, PHE140, LEU141, ASN142, SER144, CYS145 and 7 more
  • 7B77 · Crystal structure of SARS-cov-2 main protease (NSP5) in complex with compound 8 · T0W A405 · binds HIS41, MET49, TYR54, PHE140, LEU141, ASN142, SER144, CYS145 and 7 more

Residues it binds most

HIS 2, MET 2, ARG 2, ASN 2, ASP 2, CYS 2, GLN 2, GLU 2, LEU 2, PHE 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide

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