2025-08-16_00000086
|
ligand
|
7HQ2
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with CACHE3HI_1690_92;
X-ray diffraction 1.00Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1BKL
InChI=1S/C14H20N4O/c1-8-9(2)17-12-11(8)13(16-7-15-12)18-10(19)6-14(3,4)5/h7H,6H2,1-5H3,(H2,15,16,17,18,19)
InChI=1S/C14H20N4O/c1-8-9(2)17-12-11(8)13(16-7-15-12)18-10(19)6-14(3,4)5/h7H,6H2,1-5H3,(H2,15,16,17,18,19)
SMILES: Cc1c([nH]c2c1c(ncn2)NC(=O)CC(C)(C)C)C
Cc1c([nH]c2c1c(ncn2)NC(=O)CC(C)(C)C)C
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
Tube
Model
Reference
100%