2026-10-31_00000321
|
ligand
|
15LY
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005305;
X-ray diffraction 0.98Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1D3Y
InChI=1S/C13H18N4O/c1-13(8-18)4-2-6-17(7-13)12-10-3-5-14-11(10)15-9-16-12/h3,5,9,18H,2,4,6-8H2,1H3,(H,14,15,16)/t13-/m0/s1
InChI=1S/C13H18N4O/c1-13(8-18)4-2-6-17(7-13)12-10-3-5-14-11(10)15-9-16-12/h3,5,9,18H,2,4,6-8H2,1H3,(H,14,15,16)/t13-/m0/s1
SMILES: C[C@@]1(CCCN(C1)c2c3cc[nH]c3ncn2)CO
C[C@@]1(CCCN(C1)c2c3cc[nH]c3ncn2)CO
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
Tube
Model
Reference
100%