2025-10-04_00000250
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ligand
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9Q9O
TRIM21 PRYSPRY bound to compound 36;
X-ray diffraction 2.46Å
Protein #1
198 residues (92% resolved)
Raw Sequence ...
MAHHHHHHMVHITLDPDTANPWLILSEDRRQVRLGDTQQSIPGNEERFDSYPMVLGAQHFHSGKHYWEVDVTGKEAWDLGVCRDSVRRKGHFLLSSKSGFWTIWLWNKQKYEAGTYPQTPLHLQVPPCQVGIFLDYEAGMVSFYNITDHGSLIYSFSECAFTGPLRPFFSPGFNDGGKNTAPLTLCPLNIGSQGSTDY
Canonical Sequence ...
MAHHHHHHMVHITLDPDTANPWLILSEDRRQVRLGDTQQSIPGNEERFDSYPMVLGAQHFHSGKHYWEVDVTGKEAWDLGVCRDSVRRKGHFLLSSKSGFWTIWLWNKQKYEAGTYPQTPLHLQVPPCQVGIFLDYEAGMVSFYNITDHGSLIYSFSECAFTGPLRPFFSPGFNDGGKNTAPLTLCPLNIGSQGSTDY
Non polymer #2
A1I4Z
InChI=1S/C31H32N6O2/c1-22-29(20-37(35-22)19-24-6-11-27(39-3)12-7-24)28-16-25(8-13-30(28)36-15-14-33-21-36)18-34-17-23-4-9-26(10-5-23)31(38)32-2/h4-16,20-21,34H,17-19H2,1-3H3,(H,32,38)
InChI=1S/C31H32N6O2/c1-22-29(20-37(35-22)19-24-6-11-27(39-3)12-7-24)28-16-25(8-13-30(28)36-15-14-33-21-36)18-34-17-23-4-9-26(10-5-23)31(38)32-2/h4-16,20-21,34H,17-19H2,1-3H3,(H,32,38)
SMILES: Cc1c(cn(n1)Cc2ccc(cc2)OC)c3cc(ccc3n4ccnc4)CNCc5ccc(cc5)C(=O)NC
Cc1c(cn(n1)Cc2ccc(cc2)OC)c3cc(ccc3n4ccnc4)CNCc5ccc(cc5)C(=O)NC
Biounit #1
monomer
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Biounit #2
monomer
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Biounit #3
monomer
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Biounit #4
monomer
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