2026-10-03_00000222|ligand|9VI0

Complex structure of BoNT-like PG1 at pH 6.0; Electron microscopy 2.73Å
Protein #1 406 residues (92% resolved)

MIPINIKDFNYSDPVNNQDIILVKNEKGSFDKGFFVADKILLVPARYGNISTDEGGITSKKEKAHVDKKIYLETDSEKNEYLKNMTTLLKRMNSYSTGNKLLNLIIKGEPIYSKDLQGKFIEQTPSRYLDTNTGKRRVNVMITGPGSNVLTKKCTHNGMGLENDPNGKHSNGTGILSTIEFSPNYLIAYNKCVADPVLTLFHELVHSMHNLYGIAFPDNVKVPYNALKDKNLVSGEEALSEILTFGGKDLTTEHLETLWKKLAETVIIVKDFVKTDTQAKDVFLNNLRFLSKNENIKIDTIEDIVNGTLKIKNNISNLTECEFCKEIGDVRIATRAAVHSEDVTPVEVVDFKNNYKLNSGFLEGQDISKKYFITNPPKMRRRALRNFKCTIQGSGSLVPRGSGSGS

MIPINIKDFNYSDPVNNQDIILVKNEKGSFDKGFFVADKILLVPARYGNISTDEGGITSKKEKAHVDKKIYLETDSEKNEYLKNMTTLLKRMNSYSTGNKLLNLIIKGEPIYSKDLQGKFIEQTPSRYLDTNTGKRRVNVMITGPGSNVLTKKCTHNGMGLENDPNGKHSNGTGILSTIEFSPNYLIAYNKCVADPVLTLFHELVHSMHNLYGIAFPDNVKVPYNALKDKNLVSGEEALSEILTFGGKDLTTEHLETLWKKLAETVIIVKDFVKTDTQAKDVFLNNLRFLSKNENIKIDTIEDIVNGTLKIKNNISNLTECEFCKEIGDVRIATRAAVHSEDVTPVEVVDFKNNYKLNSGFLEGQDISKKYFITNPPKMRRRALRNFKCTIQGSGSLVPRGSGSGS
Protein #2 845 residues (97% resolved)

ADICASVDKKDVFAVSDTSYFKNFKFPSKKISDTGEVIDSTKLPQIKDTYKSSREEPIPDNDSTINVKNITTYHYLEAQKPKNSSIELTMVAPSKSKKPNDCVVEAINDNNKIYTPFSGTAKQFNTVVPIANTAANVITWLEAIADIFSSETGTFDKLERAGKETLYYIPYVGQLLSIGENVLIGDFKNALLNTGLIILLDIAPELNIPLLGAFEAYKEYKSLEEFRKAIDNVIDERNKRWHSVYSFVAHQWYGQVNIQIEQRLNHFYQALSYQAGVIKNRVDIEYARHKEGLEEKEERKLMWASVDCIGSIEASVKEATKNAEKFLEKSSILYFKEEILPKVHKNLEEFDKNTLFNIYTNIDEFSNRGIAEISECKKVEADVNNGFRPIKFDFSLLTNLMKSDSLTDEVILEKALEDALVFSLGVRNGKIQNLSKKWANLTIGTDIRVVHGRDNESIRLNSTQDSSIQIEKNTNLRFLDSENFSLSFWIRVPRYNKFDKDKDLNNEYTIVNNMDTATKGFKISIKNGILLWTLKGTQQKTIEIPLSNTKVSDNIWRHVAIINNKDGNCTIYVDGAQKNAVSLSGLDEITNTLPITLQLVGNKNKKQFIRLDQFNIYEKALSQTEVGKLFSSYFKDSDIRDYWGEPLAYNKTYNMINIAYQGRGLQSTNNKISLQPKAVFDPTGDGSYIPRLYRGYDVLLQKDSQSKTTDIMPKKDDLINIKLKSGHNFVGFNSTIDTSQKYLKLTTALLSEVDDPKGFKLMSLKKDNWIQIKKETWMSKNGNVIPQGLVGKRSVDSDVYLYLWDWETEKDDYSEKQWSFICQDEGWIDSDGMFTNALEHHHHHH

ADICASVDKKDVFAVSDTSYFKNFKFPSKKISDTGEVIDSTKLPQIKDTYKSSREEPIPDNDSTINVKNITTYHYLEAQKPKNSSIELTMVAPSKSKKPNDCVVEAINDNNKIYTPFSGTAKQFNTVVPIANTAANVITWLEAIADIFSSETGTFDKLERAGKETLYYIPYVGQLLSIGENVLIGDFKNALLNTGLIILLDIAPELNIPLLGAFEAYKEYKSLEEFRKAIDNVIDERNKRWHSVYSFVAHQWYGQVNIQIEQRLNHFYQALSYQAGVIKNRVDIEYARHKEGLEEKEERKLMWASVDCIGSIEASVKEATKNAEKFLEKSSILYFKEEILPKVHKNLEEFDKNTLFNIYTNIDEFSNRGIAEISECKKVEADVNNGFRPIKFDFSLLTNLMKSDSLTDEVILEKALEDALVFSLGVRNGKIQNLSKKWANLTIGTDIRVVHGRDNESIRLNSTQDSSIQIEKNTNLRFLDSENFSLSFWIRVPRYNKFDKDKDLNNEYTIVNNMDTATKGFKISIKNGILLWTLKGTQQKTIEIPLSNTKVSDNIWRHVAIINNKDGNCTIYVDGAQKNAVSLSGLDEITNTLPITLQLVGNKNKKQFIRLDQFNIYEKALSQTEVGKLFSSYFKDSDIRDYWGEPLAYNKTYNMINIAYQGRGLQSTNNKISLQPKAVFDPTGDGSYIPRLYRGYDVLLQKDSQSKTTDIMPKKDDLINIKLKSGHNFVGFNSTIDTSQKYLKLTTALLSEVDDPKGFKLMSLKKDNWIQIKKETWMSKNGNVIPQGLVGKRSVDSDVYLYLWDWETEKDDYSEKQWSFICQDEGWIDSDGMFTNALEHHHHHH
Non polymer #3 ZN

InChI=1S/Zn/q+2

[Zn+2]
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Reference