2026-10-31_00000181
|
ligand
|
15GN
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0004883;
X-ray diffraction 0.99Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1D0G
InChI=1S/C11H14N4O3S/c1-7(19(2,17)18)5-13-11(16)9-8-3-4-12-10(8)15-6-14-9/h3-4,6-7H,5H2,1-2H3,(H,13,16)(H,12,14,15)/t7-/m0/s1
InChI=1S/C11H14N4O3S/c1-7(19(2,17)18)5-13-11(16)9-8-3-4-12-10(8)15-6-14-9/h3-4,6-7H,5H2,1-2H3,(H,13,16)(H,12,14,15)/t7-/m0/s1
SMILES: C[C@@H](CNC(=O)c1c2cc[nH]c2ncn1)S(=O)(=O)C
C[C@@H](CNC(=O)c1c2cc[nH]c2ncn1)S(=O)(=O)C
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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