2026-09-12_00000007
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ligand
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12AV
Human Ornithine Aminotransferase cocrystallized with its inhibitor,(3S,4S)-3-amino-4-cyanocyclopent-1-ene-1-carboxylic acid;
X-ray diffraction 1.51Å
Protein #1
439 residues (92% resolved)
Raw Sequence ...
MFSKLAHLQRFAVLSRGVHSSVASATSVATKKTVQGPPTSDDIFEREYKYGAHNYHPLPVALERGKGIYLWDVEGRKYFDFLSSYSAVNQGHCHPKIVNALKSQVDKLTLTSRAFYNNVLGEYEEYITKLFNYHKVLPMNTGVEAGETACKLARKWGYTVKGIQKYKAKIVFAAGNFWGRTLSAISSSTDPTSYDGFGPFMPGFDIIPYNDLPALERALQDPNVAAFMVEPIQGEAGVVVPDPGYLMGVRELCTRHQVLFIADEIQTGLARTGRWLAVDYENVRPDIVLLGKALSGGLYPVSAVLCDDDIMLTIKPGEHGSTYGGNPLGCRVAIAALEVLEEENLAENADKLGIILRNELMKLPSDVVTAVRGKGLLNAIVIKETKDWDAWKVCLRLRDNGLLAKPTHGDIIRFAPPLVIKEDELRESIEIINKTILSF
Canonical Sequence ...
MFSKLAHLQRFAVLSRGVHSSVASATSVATKKTVQGPPTSDDIFEREYKYGAHNYHPLPVALERGKGIYLWDVEGRKYFDFLSSYSAVNQGHCHPKIVNALKSQVDKLTLTSRAFYNNVLGEYEEYITKLFNYHKVLPMNTGVEAGETACKLARKWGYTVKGIQKYKAKIVFAAGNFWGRTLSAISSSTDPTSYDGFGPFMPGFDIIPYNDLPALERALQDPNVAAFMVEPIQGEAGVVVPDPGYLMGVRELCTRHQVLFIADEIQTGLARTGRWLAVDYENVRPDIVLLGKALSGGLYPVSAVLCDDDIMLTIKPGEHGSTYGGNPLGCRVAIAALEVLEEENLAENADKLGIILRNELMKLPSDVVTAVRGKGLLNAIVIKETKDWDAWKVCLRLRDNGLLAKPTHGDIIRFAPPLVIKEDELRESIEIINKTILSF
Non polymer #2
A1DBF
InChI=1S/C15H16N3O7P/c1-8-14(19)12(11(5-17-8)7-25-26(22,23)24)6-18-13-3-9(15(20)21)2-10(13)4-16/h3,5,18-19H,2,6-7H2,1H3,(H,20,21)(H2,22,23,24)
InChI=1S/C15H16N3O7P/c1-8-14(19)12(11(5-17-8)7-25-26(22,23)24)6-18-13-3-9(15(20)21)2-10(13)4-16/h3,5,18-19H,2,6-7H2,1H3,(H,20,21)(H2,22,23,24)
SMILES: Cc1c(c(c(cn1)COP(=O)(O)O)CNC2=C(CC(=C2)C(=O)O)C#N)O
Cc1c(c(c(cn1)COP(=O)(O)O)CNC2=C(CC(=C2)C(=O)O)C#N)O
Biounit #1
homo-dimer
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Biounit #2
homo-dimer
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Biounit #3
homo-dimer
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Biounit #4
homo-dimer
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Biounit #5
homo-dimer
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Model
Reference
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