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Conformers: ABBIImiBZICOPNSYNN
Click the Summary/Torsions/Similar/... tabs for more details.
NMR AND MOLECULAR MODELING REVEAL THAT DIFFERENT HYDROGEN BONDING PATTERNS ARE POSSIBLE FOR GU PAIRS: ONE HYDROGEN BOND FOR EACH GU PAIR IN R(GGCGUGCC)2 AND TWO FOR EACH GU PAIR IN R(GAGUGCUC)2

Results of the assignment of 14 detected steps in 1 model(s), can be also downloaded as csv or json file. Average confal 0, percentile 0.

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Click a row in table or a step in viewer for analysis of results. Click column headers to sort data.
Define restraints for steps within Å cartesian RMSD, global sigma scaling factor or use per step sigma scaling.
step numberStep nameCANANtCconfalrmsd
011ekd_A_G1_G2AAAAA00860.13 AA00
021ekd_A_G2_C3AAAAA00770.15 AA00
031ekd_A_C3_G4AAAAA00740.22 AA00
041ekd_A_G4_U5AAAAA00680.29 AA00
051ekd_A_U5_G6AAuAA12830.21 AA12
061ekd_A_G6_C7AAAAA00810.17 AA00
071ekd_A_C7_C8AAAAA00710.22 AA00
081ekd_B_G1_G2AAAAA00880.15 AA00
091ekd_B_G2_C3AAAAA00810.16 AA00
101ekd_B_C3_G4AAAAA00770.22 AA00
111ekd_B_G4_U5AAAAA00730.29 AA00
121ekd_B_U5_G6AAuAA12840.20 AA12
131ekd_B_G6_C7AAAAA00840.17 AA00
141ekd_B_C7_C8AAAAA00800.19 AA00

Steps with non-standard or missing atoms have not been assigned, description of conformers is defined in the table.
Definition of torsion angles
step:
Table of conformers

δ1ε1ζ1α2β2γ2δ2χ1χ2μNNCC
step_torsions
ntC_average
Δ torsions
torsion scores

commentsstep confal = NaN
cartesian RMSD = NaN Å
pseudorotation: NA
details: NA
Similarity of step to class averages

Download

Results as csv or json file.
Best NtC fitted to input structure.

Restraints

Restraints file for REFMAC (steps with RMSD <= 0.5Å)
Commands file for MMB (steps with RMSD <= 0.5Å)
Restraints file for Phenix (steps with RMSD <= 0.5Å) [?]

Definitions

Average parameters (csv), esd values (csv), and Cartesian coordinates of conformers.

Download the papers

Description of DNATCO server:
Černý et al., Nucleic Acids Research, 44, W284 (2016).
Definition of conformers:
Schneider et al., Acta Cryst D, 74, 52-64 (2018).
Example of application:
Schneider et al., Genes, 8(10), 278, (2017).

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