2026-07-25_00000170|ligand|9RZB

Crystal structure of SARS-CoV-2 NSP3 Macrodomain in complex with SRI1.112 at room temperature; X-ray diffraction 1.53Å
Protein #1 170 residues (98% resolved)

GEVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFLE

GEVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFLE
Non polymer #2 A1JKG

InChI=1S/C15H12N4O3/c20-14(12-11-5-6-16-13(11)19-8-18-12)17-7-9-3-1-2-4-10(9)15(21)22/h1-6,8H,7H2,(H,17,20)(H,21,22)(H,16,18,19)

c1ccc(c(c1)CNC(=O)c2c3cc[nH]c3ncn2)C(=O)O
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Reference