2026-01-17_00000274
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ligand
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9PNL
Influenza PA-N Endonuclease E23K mutant with compound 4 ((6M)-3-hydroxy-4-oxo-6-(2-phenoxyphenyl)-1,4-dihydropyridine-2-carboxylic acid);
X-ray diffraction 2.21Å
Protein #1
192 residues (93% resolved)
Raw Sequence ...
MGSGSAMEDFVRQCFNPMIVELAEKAMKKYGEDPKIETNKFAAICTHLEVCFMYSDGGSGDPNALLKHRFEIIEGRDRIMAWTVVNSICNTTGVEKPKFLPDLYDYKENRFIEIGVTRREVHIYYLEKANKIKSEKTHIHIFSFTGEEMATKADYTLDEESRARIKTRLFTIRQEMASRSLWDSFRQSERGE
Canonical Sequence ...
MGSGSAMEDFVRQCFNPMIVELAEKAMKKYGEDPKIETNKFAAICTHLEVCFMYSDGGSGDPNALLKHRFEIIEGRDRIMAWTVVNSICNTTGVEKPKFLPDLYDYKENRFIEIGVTRREVHIYYLEKANKIKSEKTHIHIFSFTGEEMATKADYTLDEESRARIKTRLFTIRQEMASRSLWDSFRQSERGE
Non polymer #2
A1CI5
InChI=1S/C18H13NO5/c20-14-10-13(19-16(17(14)21)18(22)23)12-8-4-5-9-15(12)24-11-6-2-1-3-7-11/h1-10,21H,(H,19,20)(H,22,23)
InChI=1S/C18H13NO5/c20-14-10-13(19-16(17(14)21)18(22)23)12-8-4-5-9-15(12)24-11-6-2-1-3-7-11/h1-10,21H,(H,19,20)(H,22,23)
SMILES: c1ccc(cc1)Oc2ccccc2C3=CC(=O)C(=C(N3)C(=O)O)O
c1ccc(cc1)Oc2ccccc2C3=CC(=O)C(=C(N3)C(=O)O)O
Non polymer #3
MN
InChI=1S/Mn/q+2
InChI=1S/Mn/q+2
SMILES: [Mn+2]
[Mn+2]
Biounit #1
monomer
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Model
Reference
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