2024-06-15_00000111
|
ligand
|
8RF4
Crystal structure of N-terminal SARS-CoV-2 nsp1 in complex with fragment hit 9D4 refined against the anomalous diffraction data;
X-ray diffraction 1.11Å
Protein #1
118 residues (100% resolved)
Raw Sequence ...
MEKTHVQLSLPVLQVRDVLVRGFGDSVEEVLSEARQHLKDGTCGLVEVEKGVLPQLEQPYVFIKRSDARTAPHGHVMVELVAELEGIQYGRSGETLGVLVPHVGEIPVAYRKVLLRKN
Canonical Sequence ...
MEKTHVQLSLPVLQVRDVLVRGFGDSVEEVLSEARQHLKDGTCGLVEVEKGVLPQLEQPYVFIKRSDARTAPHGHVMVELVAELEGIQYGRSGETLGVLVPHVGEIPVAYRKVLLRKN
Non polymer #2
EQT
InChI=1S/C7H6ClN3/c8-4-2-1-3-5-6(4)7(9)11-10-5/h1-3H,(H3,9,10,11)
InChI=1S/C7H6ClN3/c8-4-2-1-3-5-6(4)7(9)11-10-5/h1-3H,(H3,9,10,11)
SMILES: c1cc2c(c(c1)Cl)c(n[nH]2)N
c1cc2c(c(c1)Cl)c(n[nH]2)N
Biounit #1
monomer
Download coordinates
Tube
Model
Reference
100%