2025-08-16_00000015|ligand|7HI0

PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0000708; X-ray diffraction 1.00Å
Protein #1 169 residues (100% resolved)

SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL

SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2 A1A7G

InChI=1S/C13H17N5O/c1-3-9-6-14-12-11(9)13(16-7-15-12)17-18-8(2)4-5-10(18)19/h6-8H,3-5H2,1-2H3,(H2,14,15,16,17)/t8-/m0/s1

CCc1c[nH]c2c1c(ncn2)NN3[C@H](CCC3=O)C
Non polymer #3 CL

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

[Cl-]
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Reference