2024-09-07_00000180
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ligand
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8W9G
Hepatitis B virus core protein Y132A mutant in complex with CBT-078;
X-ray diffraction 2.60Å
Protein #1
155 residues (100% resolved)
Raw Sequence ...
MDIDPYKEFGATVELLSFLPSDFFPSVRDLLDTAAALYRDALESPEHCSPHHTALRQAILCWGDLMTLATWVGTNLEDPASRDLVVSYVNTNVGLKFRQLLWFHISCLTFGRETVLEYLVSFGVWIRTPPAARPPNAPILSTLPETTVVENLYFQ
Canonical Sequence ...
MDIDPYKEFGATVELLSFLPSDFFPSVRDLLDTAAALYRDALESPEHCSPHHTALRQAILCWGDLMTLATWVGTNLEDPASRDLVVSYVNTNVGLKFRQLLWFHISCLTFGRETVLEYLVSFGVWIRTPPAARPPNAPILSTLPETTVVENLYFQ
Non polymer #2
5PT
InChI=1S/C21H16F2N2O2/c1-13-5-2-3-8-18(13)25-21(27)17-7-4-6-16(19(17)23)20(26)24-15-11-9-14(22)10-12-15/h2-12H,1H3,(H,24,26)(H,25,27)
InChI=1S/C21H16F2N2O2/c1-13-5-2-3-8-18(13)25-21(27)17-7-4-6-16(19(17)23)20(26)24-15-11-9-14(22)10-12-15/h2-12H,1H3,(H,24,26)(H,25,27)
SMILES: Cc1ccccc1NC(=O)c2cccc(c2F)C(=O)Nc3ccc(cc3)F
Cc1ccccc1NC(=O)c2cccc(c2F)C(=O)Nc3ccc(cc3)F
Biounit #1
homo-hexamer
Download coordinates
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Model
Reference
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