2026-10-31_00000473
|
ligand
|
15RU
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005790;
X-ray diffraction 0.97Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1PR0
InChI=1S/C10H10N8O/c19-10(12-4-2-7-15-17-18-16-7)8-6-1-3-11-9(6)14-5-13-8/h1,3,5H,2,4H2,(H,12,19)(H,11,13,14)(H,15,16,17,18)
InChI=1S/C10H10N8O/c19-10(12-4-2-7-15-17-18-16-7)8-6-1-3-11-9(6)14-5-13-8/h1,3,5H,2,4H2,(H,12,19)(H,11,13,14)(H,15,16,17,18)
SMILES: c1c[nH]c2c1c(ncn2)C(=O)NCCc3[nH]nnn3
c1c[nH]c2c1c(ncn2)C(=O)NCCc3[nH]nnn3
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
Tube
Model
Reference
100%