2026-10-31_00000325
|
ligand
|
15MC
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005319;
X-ray diffraction 0.98Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1DW9
InChI=1S/C16H12N4O2/c21-16(14-12-3-5-17-15(12)20-9-19-14)18-8-10-1-2-11-4-6-22-13(11)7-10/h1-7,9H,8H2,(H,18,21)(H,17,19,20)
InChI=1S/C16H12N4O2/c21-16(14-12-3-5-17-15(12)20-9-19-14)18-8-10-1-2-11-4-6-22-13(11)7-10/h1-7,9H,8H2,(H,18,21)(H,17,19,20)
SMILES: c1cc(cc2c1cco2)CNC(=O)c3c4cc[nH]c4ncn3
c1cc(cc2c1cco2)CNC(=O)c3c4cc[nH]c4ncn3
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
Tube
Model
Reference
100%