2026-03-21_00000211
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ligand
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9U4I
Serine Beta-Lactamase OXA-48 in complex with Dual MBL/SBL inhibitor FB1-1;
X-ray diffraction 1.85Å
Protein #1
242 residues (100% resolved)
Raw Sequence ...
EWQENKSWNAHFTEHKSQGVVVLWNENKQQGFTNNLKRANQAFLPASTF(KCX)IPNSLIALDLGVVKDEHQVFKWDGQTRDIATWNRDHNLITAMKYSVVPVYQEFARQIGEARMSKMLHAFDYGNEDISGNVDSFWLDGGIRISATEQISFLRKLYHNKLHVSERSQRIVKQAMLTEANGDYIIRAKTGYSTRIEPKIGWWVGWVELDDNVWFFAMNMDMPTSDGLGLRQAITKEVLKQEKIIP
Canonical Sequence ...
EWQENKSWNAHFTEHKSQGVVVLWNENKQQGFTNNLKRANQAFLPASTFKIPNSLIALDLGVVKDEHQVFKWDGQTRDIATWNRDHNLITAMKYSVVPVYQEFARQIGEARMSKMLHAFDYGNEDISGNVDSFWLDGGIRISATEQISFLRKLYHNKLHVSERSQRIVKQAMLTEANGDYIIRAKTGYSTRIEPKIGWWVGWVELDDNVWFFAMNMDMPTSDGLGLRQAITKEVLKQEKIIP
Non polymer #2
A1EN8
InChI=1S/C13H13BFN3O4/c15-5-10-7-18(17-16-10)6-9-2-1-8-3-4-14(21)22-12(8)11(9)13(19)20/h1-2,7,21H,3-6H2,(H,19,20)
InChI=1S/C13H13BFN3O4/c15-5-10-7-18(17-16-10)6-9-2-1-8-3-4-14(21)22-12(8)11(9)13(19)20/h1-2,7,21H,3-6H2,(H,19,20)
SMILES: B1(CCc2ccc(c(c2O1)C(=O)O)Cn3cc(nn3)CF)O
B1(CCc2ccc(c(c2O1)C(=O)O)Cn3cc(nn3)CF)O
Biounit #1
monomer
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Biounit #2
monomer
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Biounit #3
monomer
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Biounit #4
monomer
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Reference
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