2026-10-31_00000266
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ligand
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15JV
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005148;
X-ray diffraction 1.01Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1DYD
InChI=1S/C12H14N4O2/c17-10(18)5-8-2-4-16(6-8)12-9-1-3-13-11(9)14-7-15-12/h1,3,7-8H,2,4-6H2,(H,17,18)(H,13,14,15)/t8-/m1/s1
InChI=1S/C12H14N4O2/c17-10(18)5-8-2-4-16(6-8)12-9-1-3-13-11(9)14-7-15-12/h1,3,7-8H,2,4-6H2,(H,17,18)(H,13,14,15)/t8-/m1/s1
SMILES: c1c[nH]c2c1c(ncn2)N3CC[C@@H](C3)CC(=O)O
c1c[nH]c2c1c(ncn2)N3CC[C@@H](C3)CC(=O)O
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
100%