2026-10-31_00000307
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ligand
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15LK
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005269;
X-ray diffraction 1.00Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1DW7
InChI=1S/C17H16N6/c1-2-4-15-12(3-1)9-21-23(15)13-6-8-22(10-13)17-14-5-7-18-16(14)19-11-20-17/h1-5,7,9,11,13H,6,8,10H2,(H,18,19,20)/t13-/m0/s1
InChI=1S/C17H16N6/c1-2-4-15-12(3-1)9-21-23(15)13-6-8-22(10-13)17-14-5-7-18-16(14)19-11-20-17/h1-5,7,9,11,13H,6,8,10H2,(H,18,19,20)/t13-/m0/s1
SMILES: c1ccc2c(c1)cnn2[C@H]3CCN(C3)c4c5cc[nH]c5ncn4
c1ccc2c(c1)cnn2[C@H]3CCN(C3)c4c5cc[nH]c5ncn4
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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