2025-01-11_00000162
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ligand
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8XTB
Crystal structure of a novel PU plastic degradation urethanase UMG-SP2 from uncultured bacterium in complex with ligand;
X-ray diffraction 2.35Å
Protein #1
454 residues (96% resolved)
Raw Sequence ...
NLYFQGAGAGAGAGAMSELSAIETAAAIAGGSMTALEACDAAIARIEQRDGPINAVVVRDFDRARDAAKAADAEIAAAVRKPLLGVPMTIKESFDIAGLPTSWGFAEHADHIATADSLVVSRLKAAGAVFLGKSNIPVGLADWQSVNPNYGRTNNPHDHSRSAGGSSGGAAAALAAGMVPLEYGSDIGGSIRVPAHFCGVWGLKTTFDAVSLEGHYFPRTDSAKADLSVVGPMARTPADLALALDITSKVPLPQSRIANLSGLRILLLTAHPETVADSATISAVERAAAACEASGATVATSSPDLPDLSALVADYTRMLLVVLARGLAPEGTEPVSLNAWYAMLDDQARMMRAFDRLFESFDAIFCPVLGTTAFAHSDEPDWAKRSLSIDGGIAPFAAQLGWISMATYGGMPALSMPLGADGNGLPINLQIITRNWSDHDAIRIGALVAEALDR
Canonical Sequence ...
NLYFQGAGAGAGAGAMSELSAIETAAAIAGGSMTALEACDAAIARIEQRDGPINAVVVRDFDRARDAAKAADAEIAAAVRKPLLGVPMTIKESFDIAGLPTSWGFAEHADHIATADSLVVSRLKAAGAVFLGKSNIPVGLADWQSVNPNYGRTNNPHDHSRSAGGSSGGAAAALAAGMVPLEYGSDIGGSIRVPAHFCGVWGLKTTFDAVSLEGHYFPRTDSAKADLSVVGPMARTPADLALALDITSKVPLPQSRIANLSGLRILLLTAHPETVADSATISAVERAAAACEASGATVATSSPDLPDLSALVADYTRMLLVVLARGLAPEGTEPVSLNAWYAMLDDQARMMRAFDRLFESFDAIFCPVLGTTAFAHSDEPDWAKRSLSIDGGIAPFAAQLGWISMATYGGMPALSMPLGADGNGLPINLQIITRNWSDHDAIRIGALVAEALDR
Non polymer #2
A1D5H
InChI=1S/C11H16N2O3/c12-9-3-5-10(6-4-9)13-11(15)16-8-2-1-7-14/h3-6,14H,1-2,7-8,12H2,(H,13,15)
InChI=1S/C11H16N2O3/c12-9-3-5-10(6-4-9)13-11(15)16-8-2-1-7-14/h3-6,14H,1-2,7-8,12H2,(H,13,15)
SMILES: c1cc(ccc1N)NC(=O)OCCCCO
c1cc(ccc1N)NC(=O)OCCCCO
Biounit #1
homo-dimer
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Model
Reference
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