2025-05-17_00000161
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ligand
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9F8Z
Structure of the mouse 8-oxoguanine DNA Glycosylase mOGG1 in complex with ligand TH13677;
X-ray diffraction 2.50Å
Protein #1
318 residues (99% resolved)
Raw Sequence ...
GSHMRHRTLSSSPALWASIPCPRSELRLDLVLASGQSFRWKEQSPAHWSGVLADQVWTLTQTEDQLYCTVYRGDDSQVSRPTLEELETLHKYFQLDVSLAQLYSHWASVDSHFQRVAQKFQGVRLLRQDPTECLFSFICSSNNNIARITGMVERLCQAFGPRLIQLDDVTYHGFPNLHALAGPEAETHLRKLGLGYRARYVRASAKAILEEQGGPAWLQQLRVAPYEEAHKALCTLPGVGAKVADCICLMALDKPQAVPVDVHVWQIAHRDYGWHPKTSQAKGPSPLANKELGNFFRNLWGPYAGWAQAVLFSADLRQ
Canonical Sequence ...
GSHMRHRTLSSSPALWASIPCPRSELRLDLVLASGQSFRWKEQSPAHWSGVLADQVWTLTQTEDQLYCTVYRGDDSQVSRPTLEELETLHKYFQLDVSLAQLYSHWASVDSHFQRVAQKFQGVRLLRQDPTECLFSFICSSNNNIARITGMVERLCQAFGPRLIQLDDVTYHGFPNLHALAGPEAETHLRKLGLGYRARYVRASAKAILEEQGGPAWLQQLRVAPYEEAHKALCTLPGVGAKVADCICLMALDKPQAVPVDVHVWQIAHRDYGWHPKTSQAKGPSPLANKELGNFFRNLWGPYAGWAQAVLFSADLRQ
Non polymer #2
A1IBJ
InChI=1S/C11H10ClN7O/c1-20-10-7(12)2-5(3-14-10)16-8-6-4-15-19-9(6)18-11(13)17-8/h2-4H,1H3,(H4,13,15,16,17,18,19)
InChI=1S/C11H10ClN7O/c1-20-10-7(12)2-5(3-14-10)16-8-6-4-15-19-9(6)18-11(13)17-8/h2-4H,1H3,(H4,13,15,16,17,18,19)
SMILES: COc1c(cc(cn1)Nc2c3cn[nH]c3nc(n2)N)Cl
COc1c(cc(cn1)Nc2c3cn[nH]c3nc(n2)N)Cl
Non polymer #3
NI
InChI=1S/Ni/q+2
InChI=1S/Ni/q+2
SMILES: [Ni+2]
[Ni+2]
Biounit #1
monomer
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Biounit #2
monomer
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Biounit #3
monomer
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