2025-08-16_00000069
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ligand
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7HPL
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with CACHE3HI_1715_8;
X-ray diffraction 1.01Å
Protein #1
169 residues (100% resolved)
Raw Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Canonical Sequence ...
SMVNSFSGYLKLTDNVYIKNADIVEEAKKVKPTVVVNAANVYLKHGGGVAGALNKATNNAMQVESDDYIATNGPLKVGGSCVLSGHNLAKHCLHVVGPNVNKGEDIQLLKSAYENFNQHEVLLAPLLSAGIFGADPIHSLRVCVDTVRTNVYLAVFDKNLYDKLVSSFL
Non polymer #2
A1BJI
InChI=1S/C12H12N6/c1-3-16-18(5-1)9-6-17(7-9)12-10-2-4-13-11(10)14-8-15-12/h1-5,8-9H,6-7H2,(H,13,14,15)
InChI=1S/C12H12N6/c1-3-16-18(5-1)9-6-17(7-9)12-10-2-4-13-11(10)14-8-15-12/h1-5,8-9H,6-7H2,(H,13,14,15)
SMILES: c1cnn(c1)C2CN(C2)c3c4cc[nH]c4ncn3
c1cnn(c1)C2CN(C2)c3c4cc[nH]c4ncn3
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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