2026-10-31_00000318
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ligand
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15LV
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005300;
X-ray diffraction 1.02Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1D29
InChI=1S/C13H11N5O2/c19-9-2-1-8(15-6-9)5-16-13(20)11-10-3-4-14-12(10)18-7-17-11/h1-4,6-7,19H,5H2,(H,16,20)(H,14,17,18)
InChI=1S/C13H11N5O2/c19-9-2-1-8(15-6-9)5-16-13(20)11-10-3-4-14-12(10)18-7-17-11/h1-4,6-7,19H,5H2,(H,16,20)(H,14,17,18)
SMILES: c1cc(ncc1O)CNC(=O)c2c3cc[nH]c3ncn2
c1cc(ncc1O)CNC(=O)c2c3cc[nH]c3ncn2
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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