2026-10-31_00000289|ligand|15KS

PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005202; X-ray diffraction 0.98Å
Protein #1 169 residues (100% resolved)

SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL

SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2 A1D3J

InChI=1S/C13H13N5O/c1-2-11(10-4-7-19-17-10)18(6-1)13-9-3-5-14-12(9)15-8-16-13/h3-5,7-8,11H,1-2,6H2,(H,14,15,16)/t11-/m1/s1

c1c[nH]c2c1c(ncn2)N3CCC[C@@H]3c4ccon4
Non polymer #3 CL

InChI=1S/ClH/h1H/p-1

[Cl-]
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Reference