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Conformers: ABBIImiBZICOPNSYNN
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CRYSTAL STRUCTURE OF CATGGCCATG AND ITS IMPLICATIONS FOR A-TRACT BENDING MODELS

Results of the assignment of 18 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
01126d_A_DC1_DA2BBwBB02430.43 BB02
02126d_A_DA2_DT3BBBBB00640.33 BB00
03126d_A_DT3_DG4BB2BB07640.33 BB07
04126d_A_DG4_DG5miBBB15220.36 BB15
05126d_A_DG5_DC6B-ABA05530.37 BA05
06126d_A_DC6_DC7A-BAB01550.40 AB01
07126d_A_DC7_DA8BB2BB07600.34 BB07
08126d_A_DA8_DT9B-ABA05260.33 BA05
09126d_A_DT9_DG10A-BAB01680.29 AB01
10126d_B_DC11_DA12NANNANT00.57 BB02
11126d_B_DA12_DT13NANNANT00.39 BB15
12126d_B_DT13_DG14BB2BB07200.35 BB07
13126d_B_DG14_DG15NANNANT00.46 BA05
14126d_B_DG15_DC16B-ABA05770.30 BA05
15126d_B_DC16_DC17A-BAB03790.29 AB03
16126d_B_DC17_DA18BB2BB07540.32 BB07
17126d_B_DA18_DT19B-ABA05510.35 BA05
18126d_B_DT19_DG20BBBBB01110.45 BB01

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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