2025-09-13_00000024|ligand|7IJK

PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with Z8990919048; X-ray diffraction 0.98Å
Protein #1 169 residues (100% resolved)

SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL

SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2 A1CKJ

InChI=1S/C16H14N4O4/c21-13(16(23)24)11(9-4-2-1-3-5-9)20-15(22)12-10-6-7-17-14(10)19-8-18-12/h1-8,11,13,21H,(H,20,22)(H,23,24)(H,17,18,19)/t11-,13+/m0/s1

c1ccc(cc1)[C@@H]([C@H](C(=O)O)O)NC(=O)c2c3cc[nH]c3ncn2
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Reference