8TNS
Solution structure of poly(UG) RNA (GU)12 G-quadruplex
Spectrometer
Experimental method: SOLUTION NMR, SOLUTION SCATTERING
| Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
| 1 | Bruker | AVANCE III HD | 750 | |
| 2 | Bruker | AVANCE III | 600 | |
| 3 | Varian | VNMRS DD | 600 | |
| 4 | Varian | VNMRS DD | 800 |
Experiment
| experiment id | conditions id | solution id | Experiment type |
| 1 | 1 | 1 | 1D 1H |
| 10 | 1 | 5 | 2D 1H-15N HSQC BEST |
| 11 | 1 | 6 | 3D H,H,C NOESY-1H,13C-HSQC sensitivity-enhanced |
| 12 | 1 | 6 | 3D H,H,C NOESY-1H,13C-HSQC sensitivity-enhanced CC decoupled |
| 13 | 1 | 6 | 3D H,H,C 13C-filtered NOESY-1H,13C-HSQC sensitivity-enhanced CC decoupled |
| 14 | 1 | 6 | 3D H,H,C 13C-filtered NOESY-1H,13C-HSQC sensitivity-enhanced |
| 15 | 1 | 6 | 3D HCCH-TOCSY |
| 16 | 1 | 6 | 3D HCCH-COSY |
| 17 | 1 | 6 | 2D 1H-13C HSQC constant-time |
| 18 | 1 | 6 | 3D HCP sensitivity-enhanced |
| 19 | 1 | 3 | 3D H,H,C NOESY-1H,13C-HSQC sensitivity-enhanced (NOEs to ribose) |
| 2 | 1 | 5 | 1D 31P |
| 20 | 1 | 3 | 3D H,H,C NOESY-1H,13C-HSQC sensitivity-enhanced (NOEs to H8-C8) |
| 21 | 1 | 3 | 2D H,H NOESY-1H,15N-HSQC |
| 22 | 1 | 3 | 2D H,N HCN BEST |
| 23 | 1 | 3 | 2D 1H-13C HSQC sensitivity-enhanced CC decoupled |
| 24 | 1 | 3 | 2D 1H-15N HSQC long-range (H8-N9) |
| 25 | 1 | 3 | 2D 1H-13C HSQC sensitivity-enhanced |
| 26 | 1 | 3 | 2D 1H-15N HSQC BEST |
| 27 | 2 | 3 | 3D H,N,N NOESY-1H,15N-HSQC |
| 28 | 2 | 3 | 2D 1H-15N HSQC BEST |
| 29 | 2 | 3 | 2D 1H-13C HSQC sensitivity-enhanced |
| 3 | 1 | 5 | 3D H,H,C NOESY-1H,13C-HSQC sensitivity-enhanced |
| 30 | 2 | 3 | 2D 1H-13C HSQC constant-time |
| 31 | 1 | 4 | 3D H,H,C NOESY-1H,13C-HSQC sensitivity-enhanced (NOEs to Ribose) |
| 32 | 1 | 4 | 3D H,H,C NOESY-1H,13C-HSQC sensitivity-enhanced (NOEs to H8-C8) |
| 33 | 1 | 4 | 3D H,H,C 13C-filtered NOESY-1H,13C-HSQC sensitivity-enhanced (NOEs to unlabeled H8-C8) |
| 34 | 1 | 4 | 3D H,H,C 13C-filtered NOESY-1H,13C-HSQC sensitivity-enhanced (NOEs to unlabeled Ribose) |
| 35 | 1 | 4 | 3D HCCH-TOCSY |
| 36 | 1 | 4 | 3D HCCH-COSY |
| 37 | 1 | 4 | 2D 1H-13C HSQC constant-time |
| 38 | 1 | 4 | 3D HCP sensitivity-enhanced |
| 39 | 1 | 2 | 2D 1H-1H NOESY (200 ms mix. time) |
| 4 | 1 | 5 | 3D H,H,C NOESY-1H,13C-HSQC sensitivity-enhanced CC decoupled |
| 40 | 1 | 2 | 2D 1H-1H NOESY (350 ms mix. time) |
| 41 | 1 | 2 | 2D 1H-1H TOCSY |
| 42 | 1 | 1 | 2D 1H-1H NOESY |
| 43 | 1 | 7 | 2D 1H-1H NOESY |
| 44 | 1 | 7 | 2D 1H-1H TOCSY |
| 45 | 2 | 7 | 2D 1H-1H NOESY |
| 46 | 2 | 7 | 2D 1H-1H TOCSY |
| 47 | 1 | 8 | 2D 1H-1H NOESY |
| 48 | 1 | 8 | 2D 1H-1H TOCSY |
| 49 | 2 | 8 | 2D 1H-1H NOESY |
| 5 | 1 | 5 | 2D H,H NOESY-1H,15N-HSQC |
| 50 | 2 | 8 | 2D 1H-1H TOCSY |
| 51 | 1 | 9 | 2D 1H-1H NOESY |
| 52 | 1 | 9 | 2D 1H-1H TOCSY |
| 53 | 2 | 9 | 2D 1H-1H NOESY |
| 54 | 2 | 9 | 2D 1H-1H TOCSY |
| 55 | 1 | 10 | 2D 1H-1H NOESY |
| 56 | 1 | 10 | 2D 1H-1H TOCSY |
| 57 | 2 | 10 | 2D 1H-1H NOESY |
| 58 | 2 | 10 | 2D 1H-1H TOCSY |
| 59 | 1 | 11 | 2D 1H-1H NOESY |
| 6 | 1 | 5 | 2D H,N HCN BEST |
| 60 | 2 | 11 | 2D 1H-1H NOESY |
| 61 | 1 | 12 | 2D 1H-1H NOESY |
| 62 | 2 | 12 | 2D 1H-1H NOESY |
| 63 | 1 | 13 | 2D 1H-1H NOESY |
| 64 | 1 | 4 | 2D 1H-13C HSQC sensitivity-enhanced CC decoupled |
| 65 | 1 | 6 | 2D 1H-13C HSQC sensitivity-enhanced CC decoupled |
| 66 | 1 | 3 | 2D 1H-15N HSQC long-range (H8-N7) |
| 67 | 1 | 5 | 2D 13C-15N CON (C2-N1) |
| 68 | 1 | 5 | 2D 13C-15N CON (C2-N3) |
| 69 | 1 | 5 | 2D 1H-13C HN(CA)CO (H3-C2) |
| 7 | 1 | 5 | 2D 1H-13C HSQC sensitivity-enhanced CC decoupled (H1'-C1' H5-C5) |
| 70 | 1 | 14 | 2D ARTSY |
| 71 | 1 | 15 | 2D ARTSY |
| 8 | 1 | 5 | 2D 1H-15N HSQC long-range |
| 9 | 1 | 5 | 2D 1H-13C HSQC sensitivity-enhanced CC decoupled (H6-C6) |
NMR Sample
| conditions id | NMR sample pH | NMR sample pressure | NMR sample temperature |
| 1 | 7 | 1 | 293 |
| 2 | 7 | 1 | 276 |
Conformers
| Conformers Calculated Total Number | 100 |
| Conformers Submitted Total Number | 20 |
Refinement Statistics
Experimental method: SOLUTION NMR, SOLUTION SCATTERING
| Cell axes | |||
| Cell angles | |||
| Spacegroup | |||
| Resolution limits | - | ||
