2026-01-10_00000295
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ligand
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9LER
Structure of FtmoX1 complexes with alkylamine derivative;
X-ray diffraction 1.68Å
Protein #1
291 residues (99% resolved)
Raw Sequence ...
MTVDSKPQLQRLAADADVDRMCRLLEEDGAFILKGLLPFDVVESFNRELDVQMAIPPPKGERLLADKYPPHFKYVPNVATTCPTFRNTVLINPVIHAICEAYFQRTGDYWLSAAFLREIESGMPAQPFHRDDATHPLMHYQPLEAPPVSLSVIFPLTEFTEENGATEVILGSHRWTEVGTPERDQAVLATMDPGDVLIVRQRVVHAGGGNRTTAGKPRRVVLAYFNSVQLTPFETYRTMPREMVESMTVLGQRMLGWRTMKPSDPNIVGINLIDDKRLENVLQLKAADSPA
Canonical Sequence ...
MTVDSKPQLQRLAADADVDRMCRLLEEDGAFILKGLLPFDVVESFNRELDVQMAIPPPKGERLLADKYPPHFKYVPNVATTCPTFRNTVLINPVIHAICEAYFQRTGDYWLSAAFLREIESGMPAQPFHRDDATHPLMHYQPLEAPPVSLSVIFPLTEFTEENGATEVILGSHRWTEVGTPERDQAVLATMDPGDVLIVRQRVVHAGGGNRTTAGKPRRVVLAYFNSVQLTPFETYRTMPREMVESMTVLGQRMLGWRTMKPSDPNIVGINLIDDKRLENVLQLKAADSPA
Non polymer #2
A1EKG
InChI=1S/C21H26N2O4/c1-26-20-8-4-17(5-9-20)10-11-23(16-18-2-6-19(24)7-3-18)21(25)22-12-14-27-15-13-22/h2-9,24H,10-16H2,1H3
InChI=1S/C21H26N2O4/c1-26-20-8-4-17(5-9-20)10-11-23(16-18-2-6-19(24)7-3-18)21(25)22-12-14-27-15-13-22/h2-9,24H,10-16H2,1H3
SMILES: COc1ccc(cc1)CCN(Cc2ccc(cc2)O)C(=O)N3CCOCC3
COc1ccc(cc1)CCN(Cc2ccc(cc2)O)C(=O)N3CCOCC3
Non polymer #3
AKG
InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
SMILES: C(CC(=O)O)C(=O)C(=O)O
C(CC(=O)O)C(=O)C(=O)O
Non polymer #4
CO
InChI=1S/Co/q+2
InChI=1S/Co/q+2
SMILES: [Co+2]
[Co+2]
Biounit #1
homo-dimer
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Model
Reference
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