2026-10-31_00000388
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ligand
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15ON
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005659;
X-ray diffraction 1.02Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1DTC
InChI=1S/C12H16N4O3/c1-6(2)9(4-17)16-11-7-3-8(12(18)19)15-10(7)13-5-14-11/h3,5-6,9,17H,4H2,1-2H3,(H,18,19)(H2,13,14,15,16)/t9-/m0/s1
InChI=1S/C12H16N4O3/c1-6(2)9(4-17)16-11-7-3-8(12(18)19)15-10(7)13-5-14-11/h3,5-6,9,17H,4H2,1-2H3,(H,18,19)(H2,13,14,15,16)/t9-/m0/s1
SMILES: CC(C)[C@H](CO)Nc1c2cc([nH]c2ncn1)C(=O)O
CC(C)[C@H](CO)Nc1c2cc([nH]c2ncn1)C(=O)O
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
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Model
Reference
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