2025-07-12_00000212
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ligand
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9M3N
Crystal structure of human TRIM21 PRYSPRY in complex with T-02;
X-ray diffraction 2.08Å
Protein #1
180 residues (100% resolved)
Raw Sequence ...
CAVHITLDPDTANPWLILSEDRRQVRLGDTQQSIPGNEERFDSYPMVLGAQHFHSGKHYWEVDVTGKEAWDLGVCRDSVRRKGHFLLSSKSGFWTIWLWNKQKYEAGTYPQTPLHLQVPPCQVGIFLDYEAGMVSFYNITDHGSLIYSFSECAFTGPLRPFFSPGFNDGGKNTAPLTLCP
Canonical Sequence ...
CAVHITLDPDTANPWLILSEDRRQVRLGDTQQSIPGNEERFDSYPMVLGAQHFHSGKHYWEVDVTGKEAWDLGVCRDSVRRKGHFLLSSKSGFWTIWLWNKQKYEAGTYPQTPLHLQVPPCQVGIFLDYEAGMVSFYNITDHGSLIYSFSECAFTGPLRPFFSPGFNDGGKNTAPLTLCP
Non polymer #2
A1EMT
InChI=1S/C24H24F3N3O/c1-3-30-22(16-8-5-4-6-9-16)21(15-28-30)23(31)29(2)20-13-18(14-20)17-10-7-11-19(12-17)24(25,26)27/h4-12,15,18,20H,3,13-14H2,1-2H3/t18-,20+
InChI=1S/C24H24F3N3O/c1-3-30-22(16-8-5-4-6-9-16)21(15-28-30)23(31)29(2)20-13-18(14-20)17-10-7-11-19(12-17)24(25,26)27/h4-12,15,18,20H,3,13-14H2,1-2H3/t18-,20+
SMILES: CCn1c(c(cn1)C(=O)N(C)C2CC(C2)c3cccc(c3)C(F)(F)F)c4ccccc4
CCn1c(c(cn1)C(=O)N(C)C2CC(C2)c3cccc(c3)C(F)(F)F)c4ccccc4
Biounit #1
monomer
Download coordinates
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Model
Reference
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