2026-01-24_00000237
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ligand
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9RRP
Tankyrase 2 in complex with an inhibitor;
X-ray diffraction 2.05Å
Protein #1
218 residues (95% resolved)
Raw Sequence ...
SMLNTSGSGTILIDLSPDDKEFQSVEEEMQSTVREHRDGGHAGGIFNRYNILKIQKVCNKKLWERYTHRRKEVSEENHNHANERMLFHGSPFVNAIIHKGFDERHAYIGGMFGAGIYFAENSSKSNQYVYGIGGGTGCPVHKDRSCYICHRQLLFCRVTLGKSFLQFSAMKMAHSPPGHHSVTGRPSVNGLALAEYVIYRGEQAYPEYLITYQIMRPE
Canonical Sequence ...
SMLNTSGSGTILIDLSPDDKEFQSVEEEMQSTVREHRDGGHAGGIFNRYNILKIQKVCNKKLWERYTHRRKEVSEENHNHANERMLFHGSPFVNAIIHKGFDERHAYIGGMFGAGIYFAENSSKSNQYVYGIGGGTGCPVHKDRSCYICHRQLLFCRVTLGKSFLQFSAMKMAHSPPGHHSVTGRPSVNGLALAEYVIYRGEQAYPEYLITYQIMRPE
Non polymer #2
A1JI1
InChI=1S/C17H13FN4O2/c1-24-12-5-2-10(3-6-12)9-22-16-15(20-21-22)13-7-4-11(18)8-14(13)17(23)19-16/h2-8H,9H2,1H3,(H,19,23)
InChI=1S/C17H13FN4O2/c1-24-12-5-2-10(3-6-12)9-22-16-15(20-21-22)13-7-4-11(18)8-14(13)17(23)19-16/h2-8H,9H2,1H3,(H,19,23)
SMILES: COc1ccc(cc1)Cn2c3c(nn2)-c4ccc(cc4C(=O)N3)F
COc1ccc(cc1)Cn2c3c(nn2)-c4ccc(cc4C(=O)N3)F
Non polymer #3
PEG
InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2
InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2
SMILES: C(COCCO)O
C(COCCO)O
Non polymer #4
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
monomer
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Model
Reference
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