2026-10-31_00000257
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ligand
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15JM
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005120;
X-ray diffraction 1.02Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1DUZ
InChI=1S/C14H16N6/c1-2-11(8-19-7-5-15-10-19)20(6-1)14-12-3-4-16-13(12)17-9-18-14/h3-5,7,9-11H,1-2,6,8H2,(H,16,17,18)/t11-/m1/s1
InChI=1S/C14H16N6/c1-2-11(8-19-7-5-15-10-19)20(6-1)14-12-3-4-16-13(12)17-9-18-14/h3-5,7,9-11H,1-2,6,8H2,(H,16,17,18)/t11-/m1/s1
SMILES: c1c[nH]c2c1c(ncn2)N3CCC[C@@H]3Cn4ccnc4
c1c[nH]c2c1c(ncn2)N3CCC[C@@H]3Cn4ccnc4
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
100%