2026-01-10_00000296
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ligand
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9LES
Structure of FtmoX1 complexes with alkylamine derivative products;
X-ray diffraction 1.69Å
Protein #1
290 residues (99% resolved)
Raw Sequence ...
MTVDSKPQLQRLAADADVDRMCRLLEEDGAFILKGLLPFDVVESFNRELDVQMAIPPPKGERLLADKYPPHFKYVPNVATTCPTFRNTVLINPVIHAICEAYFQRTGDYWLSAAFLREIESGMPAQPFHRDDATHPLMHYQPLEAPPVSLSVIFPLTEFTEENGATEVILGSHRWTEVGTPERDQAVLATMDPGDVLIVRQRVVHAGGGNRTTAGKPRRVVLAYFNSVQLTPFETYRTMPREMVESMTVLGQRMLGWRTMKPSDPNIVGINLIDDKRLENVLQLKAADSP
Canonical Sequence ...
MTVDSKPQLQRLAADADVDRMCRLLEEDGAFILKGLLPFDVVESFNRELDVQMAIPPPKGERLLADKYPPHFKYVPNVATTCPTFRNTVLINPVIHAICEAYFQRTGDYWLSAAFLREIESGMPAQPFHRDDATHPLMHYQPLEAPPVSLSVIFPLTEFTEENGATEVILGSHRWTEVGTPERDQAVLATMDPGDVLIVRQRVVHAGGGNRTTAGKPRRVVLAYFNSVQLTPFETYRTMPREMVESMTVLGQRMLGWRTMKPSDPNIVGINLIDDKRLENVLQLKAADSP
Non polymer #2
A1EKF
InChI=1S/C21H26N2O5/c1-27-19-8-4-17(5-9-19)20(25)15-23(14-16-2-6-18(24)7-3-16)21(26)22-10-12-28-13-11-22/h2-9,20,24-25H,10-15H2,1H3/t20-/m0/s1
InChI=1S/C21H26N2O5/c1-27-19-8-4-17(5-9-19)20(25)15-23(14-16-2-6-18(24)7-3-16)21(26)22-10-12-28-13-11-22/h2-9,20,24-25H,10-15H2,1H3/t20-/m0/s1
SMILES: COc1ccc(cc1)[C@H](CN(Cc2ccc(cc2)O)C(=O)N3CCOCC3)O
COc1ccc(cc1)[C@H](CN(Cc2ccc(cc2)O)C(=O)N3CCOCC3)O
Non polymer #3
CO
InChI=1S/Co/q+2
InChI=1S/Co/q+2
SMILES: [Co+2]
[Co+2]
Non polymer #4
SIN
InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
SMILES: C(CC(=O)O)C(=O)O
C(CC(=O)O)C(=O)O
Biounit #1
homo-dimer
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Model
Reference
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