2026-06-27_00000098|hard|9L8F

Crystal structure of RhoBAST aptamer in complex with TMR; X-ray diffraction 2.51Å

RNA #1 57 bases

Raw Sequence ...

(GDP)GAACCUCCGCCGAAAGGCGGUGAAGGAGAGGCGCAAGGUUAACCGCCUCAGGUUCC

Canonical Sequence ...

GGAACCUCCGCCGAAAGGCGGUGAAGGAGAGGCGCAAGGUUAACCGCCUCAGGUUCC

Non polymer #2 A1EI4

InChI=1S/C24H22N2O3/c1-25(2)15-9-11-19-21(13-15)29-22-14-16(26(3)4)10-12-20(22)23(19)17-7-5-6-8-18(17)24(27)28/h5-14H,1-4H3/p+1

InChI=1S/C24H22N2O3/c1-25(2)15-9-11-19-21(13-15)29-22-14-16(26(3)4)10-12-20(22)23(19)17-7-5-6-8-18(17)24(27)28/h5-14H,1-4H3/p+1

SMILES: CN(C)c1ccc2c(c1)OC3=CC(=[N+](C)C)C=CC3=C2c4ccccc4C(=O)O

CN(C)c1ccc2c(c1)OC3=CC(=[N+](C)C)C=CC3=C2c4ccccc4C(=O)O

Non polymer #3 MG

InChI=1S/Mg/q+2

InChI=1S/Mg/q+2

SMILES: [Mg+2]

[Mg+2]

Non polymer #4 SE

InChI=1S/H2Se/h1H2

InChI=1S/H2Se/h1H2

SMILES: [SeH2]

[SeH2]

Biounit #1 homo-dimer

Reference