2025-07-05_00000287
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ligand
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9RID
SARS-CoV-2 with a bound inhibitor;
X-ray diffraction 1.63Å
Protein #1
306 residues (99% resolved)
Raw Sequence ...
SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRHVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGHSMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSCGSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
Canonical Sequence ...
SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRHVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGHSMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSCGSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
Non polymer #2
A1JGI
InChI=1S/C17H16FN5O2/c1-22(16(17(19)25)11-5-4-6-12(18)9-11)15(24)10-23-14-8-3-2-7-13(14)20-21-23/h2-9,16H,10H2,1H3,(H2,19,25)/t16-/m1/s1
InChI=1S/C17H16FN5O2/c1-22(16(17(19)25)11-5-4-6-12(18)9-11)15(24)10-23-14-8-3-2-7-13(14)20-21-23/h2-9,16H,10H2,1H3,(H2,19,25)/t16-/m1/s1
SMILES: CN([C@H](c1cccc(c1)F)C(=O)N)C(=O)Cn2c3ccccc3nn2
CN([C@H](c1cccc(c1)F)C(=O)N)C(=O)Cn2c3ccccc3nn2
Non polymer #3
NA
InChI=1S/Na/q+1
InChI=1S/Na/q+1
SMILES: [Na+]
[Na+]
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
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