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Conformers: ABBIImiBZICOPNSYNN
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MONOVALENT CATIONS SEQUESTER WITHIN THE A-TRACT MINOR GROOVE OF [D(CGCGAATTCGCG)]2

Results of the assignment of 22 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
011dou_A_DC1_DG2BBBBB00790.25 BB00
021dou_A_DG2_DC3B12BB04450.19 BB04
031dou_A_DC3_DG4BBBBB00520.36 BB00
041dou_A_DG4_DA5B12BB04780.21 BB04
051dou_A_DA5_DA6BBBBB00930.12 BB00
061dou_A_DA6_DT7BBBBB00790.20 BB00
071dou_A_DT7_DT8BBBBB00730.20 BB00
081dou_A_DT8_DC9BBBBB00830.25 BB00
091dou_A_DC9_DG10BBBBB00730.37 BB00
101dou_A_DG10_DC11BB2BB07780.36 BB07
111dou_A_DC11_DG12BBBBB00630.42 BB00
121dou_B_DC13_DG14BBBBB00910.12 BB00
131dou_B_DG14_DC15B-ABA01780.22 BA01
141dou_B_DC15_DG16A-BAB01890.15 AB01
151dou_B_DG16_DA17BBBBB00590.31 BB00
161dou_B_DA17_DA18BBBBB00820.16 BB00
171dou_B_DA18_DT19BBBBB00810.27 BB00
181dou_B_DT19_DT20BBBBB00870.16 BB00
191dou_B_DT20_DC21BBwBB02890.14 BB02
201dou_B_DC21_DG22BBBBB00780.37 BB00
211dou_B_DG22_DC23B-ABA08700.36 BA08
221dou_B_DC23_DG24AAAAA00750.23 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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