2026-07-25_00000059
|
ligand
|
32QM
Human TRIM21 PRYSPRY domain in complex with compound 5 (Z31);
X-ray diffraction 1.50Å
Protein #1
181 residues (99% resolved)
Raw Sequence ...
SMVHITLDPDTANPWLILSEDRRQVRLGDTQQSIPGNEERFDSYPMVLGAQHFHSGKHYWEVDVTGKEAWDLGVCRDSVRRKGHFLLSSKSGFWTIWLWNKQKYEAGTYPQTPLHLQVPPCQVGIFLDYEAGMVSFYNITDHGSLIYSFSECAFTGPLRPFFSPGFNDGGKNTAPLTLCPL
Canonical Sequence ...
SMVHITLDPDTANPWLILSEDRRQVRLGDTQQSIPGNEERFDSYPMVLGAQHFHSGKHYWEVDVTGKEAWDLGVCRDSVRRKGHFLLSSKSGFWTIWLWNKQKYEAGTYPQTPLHLQVPPCQVGIFLDYEAGMVSFYNITDHGSLIYSFSECAFTGPLRPFFSPGFNDGGKNTAPLTLCPL
Non polymer #2
A1KEE
InChI=1S/C24H30FNO3S2/c1-16(17-8-6-5-7-9-17)26(2)24(27)21-12-10-18(14-23(21)31(4,28)29)20-13-11-19(25)15-22(20)30-3/h10-17H,5-9H2,1-4H3/t16-/m1/s1
InChI=1S/C24H30FNO3S2/c1-16(17-8-6-5-7-9-17)26(2)24(27)21-12-10-18(14-23(21)31(4,28)29)20-13-11-19(25)15-22(20)30-3/h10-17H,5-9H2,1-4H3/t16-/m1/s1
SMILES: C[C@H](C1CCCCC1)N(C)C(=O)c2ccc(cc2S(=O)(=O)C)c3ccc(cc3SC)F
C[C@H](C1CCCCC1)N(C)C(=O)c2ccc(cc2S(=O)(=O)C)c3ccc(cc3SC)F
Non polymer #3
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Biounit #1
monomer
Download coordinates
Tube
Model
Reference
100%