2026-10-31_00000464
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ligand
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15RL
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with AVI-0005614;
X-ray diffraction 0.96Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1PRB
InChI=1S/C12H17N3O3/c1-8(6-7-16)14-11(17)9-2-4-10(5-3-9)15-12(13)18/h2-5,8,16H,6-7H2,1H3,(H,14,17)(H3,13,15,18)/t8-/m1/s1
InChI=1S/C12H17N3O3/c1-8(6-7-16)14-11(17)9-2-4-10(5-3-9)15-12(13)18/h2-5,8,16H,6-7H2,1H3,(H,14,17)(H3,13,15,18)/t8-/m1/s1
SMILES: C[C@H](CCO)NC(=O)c1ccc(cc1)NC(=O)N
C[C@H](CCO)NC(=O)c1ccc(cc1)NC(=O)N
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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