2025-10-18_00000007
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ligand
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7IBF
PanDDA analysis group deposition -- SARS-CoV-2 Nsp1 in complex with fragment X4161 (well F07) from the KIT library;
X-ray diffraction 1.61Å
Protein #1
116 residues (97% resolved)
Raw Sequence ...
EKTHVQLSLPVLQVRDVLVRGFGDSVEEVLSEARQHLKDGTCGLVEVEKGVLPQLEQPYVFIKRSDARTAPHGHVMVELVAELEGIQYGRSGETLGVLVPHVGEIPVAYRKVLLRK
Canonical Sequence ...
EKTHVQLSLPVLQVRDVLVRGFGDSVEEVLSEARQHLKDGTCGLVEVEKGVLPQLEQPYVFIKRSDARTAPHGHVMVELVAELEGIQYGRSGETLGVLVPHVGEIPVAYRKVLLRK
Non polymer #2
A1CS1
InChI=1S/C10H12N2O2/c13-8-3-1-7(2-4-8)9-10(14)12-6-5-11-9/h1-4,9,11,13H,5-6H2,(H,12,14)/t9-/m0/s1
InChI=1S/C10H12N2O2/c13-8-3-1-7(2-4-8)9-10(14)12-6-5-11-9/h1-4,9,11,13H,5-6H2,(H,12,14)/t9-/m0/s1
SMILES: c1cc(ccc1C2C(=O)NCCN2)O
c1cc(ccc1C2C(=O)NCCN2)O
Biounit #1
monomer
Download coordinates
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Model
Reference
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