2026-10-31_00000251
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ligand
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15JG
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005095;
X-ray diffraction 0.98Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1D2E
InChI=1S/C10H10N4O2/c15-6-3-14(4-6)10(16)8-7-1-2-11-9(7)13-5-12-8/h1-2,5-6,15H,3-4H2,(H,11,12,13)
InChI=1S/C10H10N4O2/c15-6-3-14(4-6)10(16)8-7-1-2-11-9(7)13-5-12-8/h1-2,5-6,15H,3-4H2,(H,11,12,13)
SMILES: c1c[nH]c2c1c(ncn2)C(=O)N3CC(C3)O
c1c[nH]c2c1c(ncn2)C(=O)N3CC(C3)O
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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