2026-08-22_00000226|ligand|33FE

Crystal Structure of the beta-Glucosidase BglA9 in Complex with the Inhibitor Conduritol B Epoxide; X-ray diffraction 1.74Å
Protein #1 466 residues (97% resolved)

MVLQFPKDFIWGAATSSYQIEGTATGEDKIYSIWDHFSRIPGKVANGDNGDIAIDHYNRYVEDIALMKALHLKAYRFSTSWARLYCETPGKFNEKGLDFYKRLVHELLENGIEPMLTIYHWDMPQALQEKGGWENRDIVHYFQEYAAFLYENLGDVVKKWITHNEPWVVTYLGYGNGEHAPGIQNFTSFLKAAHHVLLSHGEAVKAFRAIGSKDGEIGITLNLTPGYAVDPKDEKAVDAARKWDGFMNRWFLDPVFKGQYPADMLEVYKDYLPDVYKEGDLQTIQQPIDFFGFNYYSTATLKDWKTGDREPIVFEHVSTGRPVTDMNWEVNPNGLFDLMVRLKKDYGDIPLYITENGAAYKDRVNEQGEVEDDERVAYIREHLIACHRAIEQGVNLKGYYVWSLFDNFEWAFGYDKRFGIVYVDYETLERIPKKSALWYKETIINNGLQVDNDKKLAAALEHHHHH

MVLQFPKDFIWGAATSSYQIEGTATGEDKIYSIWDHFSRIPGKVANGDNGDIAIDHYNRYVEDIALMKALHLKAYRFSTSWARLYCETPGKFNEKGLDFYKRLVHELLENGIEPMLTIYHWDMPQALQEKGGWENRDIVHYFQEYAAFLYENLGDVVKKWITHNEPWVVTYLGYGNGEHAPGIQNFTSFLKAAHHVLLSHGEAVKAFRAIGSKDGEIGITLNLTPGYAVDPKDEKAVDAARKWDGFMNRWFLDPVFKGQYPADMLEVYKDYLPDVYKEGDLQTIQQPIDFFGFNYYSTATLKDWKTGDREPIVFEHVSTGRPVTDMNWEVNPNGLFDLMVRLKKDYGDIPLYITENGAAYKDRVNEQGEVEDDERVAYIREHLIACHRAIEQGVNLKGYYVWSLFDNFEWAFGYDKRFGIVYVDYETLERIPKKSALWYKETIINNGLQVDNDKKLAAALEHHHHH
Non polymer #2 CBU

InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4-,5+,6+/m0/s1

C1(C(C(C(C(C1O)O)O)O)O)O
Non polymer #3 MG

InChI=1S/Mg/q+2

[Mg+2]
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Reference