2026-07-25_00000155
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ligand
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9RYH
Crystal structure of SARS-CoV-2 NSP3 Macrodomain in complex with SRI1.66 at room temperature;
X-ray diffraction 1.82Å
Protein #1
170 residues (98% resolved)
Raw Sequence ...
GEVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFLE
Canonical Sequence ...
GEVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFLE
Non polymer #2
A1JKH
InChI=1S/C20H16N4O/c25-20(18-17-10-11-21-19(17)24-13-23-18)22-12-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-11,13H,12H2,(H,22,25)(H,21,23,24)
InChI=1S/C20H16N4O/c25-20(18-17-10-11-21-19(17)24-13-23-18)22-12-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-11,13H,12H2,(H,22,25)(H,21,23,24)
SMILES: c1ccc(cc1)c2ccc(cc2)CNC(=O)c3c4cc[nH]c4ncn3
c1ccc(cc1)c2ccc(cc2)CNC(=O)c3c4cc[nH]c4ncn3
Biounit #1
monomer
Download coordinates
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Model
Reference
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