2026-10-31_00000433
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ligand
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15QG
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005818;
X-ray diffraction 0.97Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1PRW
InChI=1S/C15H16N4/c1-11(12-5-3-2-4-6-12)9-17-15-13-7-8-16-14(13)18-10-19-15/h2-8,10-11H,9H2,1H3,(H2,16,17,18,19)/t11-/m0/s1
InChI=1S/C15H16N4/c1-11(12-5-3-2-4-6-12)9-17-15-13-7-8-16-14(13)18-10-19-15/h2-8,10-11H,9H2,1H3,(H2,16,17,18,19)/t11-/m0/s1
SMILES: C[C@@H](CNc1c2cc[nH]c2ncn1)c3ccccc3
C[C@@H](CNc1c2cc[nH]c2ncn1)c3ccccc3
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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