6SNJ

Solution structure of the FUS/TLS RNA recognition motif in complex with U1 snRNA stem loop III


SOLUTION NMR
NMR Experiment
ExperimentTypeSample ContentsSolventIonic StrengthpHPressureTemperature (K)Spectrometer
12D 1H-15N HSQC1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE III 600
22D 1H-13C HSQC aliphatic1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE III 600
32D 1H-13C HSQC aromatic1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE III 600
42D 1H-13C HSQC aliphatic1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE III 600
52D 1H-13C HSQC aromatic1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE III 600
143D 1H-15N NOESY1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE 900
133D 1H-13C NOESY aliphatic1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE 900
123D 1H-13C NOESY aromatic1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE 900
113D 1H-13C NOESY aliphatic1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE III 700
103D 1H-13C NOESY aromatic1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE III 700
92D 1H-13C HSQC aliphatic1 mM FUS/TLS RNA recognition motif (260-390), 0.8 mM [U-13C; U-15N] SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE 900
82D 1H-13C HSQC aromatic1 mM FUS/TLS RNA recognition motif (260-390), 0.8 mM [U-13C; U-15N] SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE 900
73D 1H-13C NOESY1 mM FUS/TLS RNA recognition motif (260-390), 0.8 mM [U-13C; U-15N] SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE 900
63D HCCH-TOCSY1 mM FUS/TLS RNA recognition motif (260-390), 0.8 mM [U-13C; U-15N] SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE III 700
193D HNCACB1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE III 600
183D CBCA(CO)NH1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE III 600
173D HNCO1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE III 600
163D HNCA1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE III 600
152D 1H-1H NOESY1 mM FUS/TLS RNA recognition motif (260-390), 1 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT90% H2O/10% D2O60 mM6.8atm atm303Bruker AVANCE 900
222D F1FF2f NOESY1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE III 700
212D F2F NOEY1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE III 700
202D F1fF2F TOCSY1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE III 700
243D 1H-13C filtered edited NOESY HSQC1.2 mM [U-99% 13C; U-99% 15N] FUS/TLS RNA recognition motif (260-390), 1.5 mM SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE 900
233D 1H-13C filtered edited NOESY HSQC1 mM FUS/TLS RNA recognition motif (260-390), 0.8 mM [U-13C; U-15N] SL3, 10 mM sodium phosphate, 50 mM sodium chloride, 2 mM DTT100% D2O60 mM6.8atm atm303Bruker AVANCE 900
NMR Spectrometer Information
SpectrometerManufacturerModelField Strength
1BrukerAVANCE III600
2BrukerAVANCE III700
3BrukerAVANCE900
NMR Refinement
MethodDetailsSoftware
simulated annealingAmber
NMR Ensemble Information
Conformer Selection Criteriastructures with the lowest energy
Conformers Calculated Total Number50
Conformers Submitted Total Number18
Representative Model1 (lowest energy)
Computation: NMR Software
#ClassificationVersionSoftware NameAuthor
1refinementAmber12Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman
2structure calculationCYANA3.98Guntert, Mumenthaler and Wuthrich
3chemical shift assignmentCARAKeller and Wuthrich
4peak pickingCYANAGuntert, Mumenthaler and Wuthrich