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Conformers: ABBIImiBZICOPNSYNN
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Structure of B-DNA d(CGTTAATTAACG)2 in the presence of Manganese

Results of the assignment of 60 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
013eil_A_DG2_DT3B-ABA08610.40 BA08
023eil_A_DT3_DT4BBBBB01550.39 BB01
033eil_A_DT4_DA5BBBBB00500.29 BB00
043eil_A_DA5_DA6BBBBB00560.24 BB00
053eil_A_DA6_DT7BBBBB00610.30 BB00
063eil_A_DT7_DT8BBBBB00670.23 BB00
073eil_A_DT8_DA9miBBB15240.38 BB15
083eil_A_DA9_DA10BBBBB01410.24 BB01
093eil_A_DA10_DC11A-BAB03900.18 AB03
103eil_A_DC11_DG12NANNANT01.27 BB04
113eil_B_DG2_DT3B-ABA05710.29 BA05
123eil_B_DT3_DT4BBBBB01480.38 BB01
133eil_B_DT4_DA5BBBBB00600.29 BB00
143eil_B_DA5_DA6BBBBB00770.19 BB00
153eil_B_DA6_DT7BBBBB00610.34 BB00
163eil_B_DT7_DT8BBBBB00870.19 BB00
173eil_B_DT8_DA9BBBBB00110.26 BB00
183eil_B_DA9_DA10BBBBB00140.24 BB00
193eil_B_DA10_DC11BBBBB00360.21 BB00
203eil_B_DC11_DG12NANNANT01.39 BB04
213eil_C_DG2_DT3B-ABA05160.47 BA05
223eil_C_DT3_DT4BBBBB01360.39 BB01
233eil_C_DT4_DA5BBBBB00480.29 BB00
243eil_C_DA5_DA6BBBBB00620.23 BB00
253eil_C_DA6_DT7BBBBB00480.33 BB00
263eil_C_DT7_DT8BBBBB00890.16 BB00
273eil_C_DT8_DA9BBBBB00110.27 BB00
283eil_C_DA9_DA10B-ABA05820.21 BA05
293eil_C_DA10_DC11A-BAB01180.32 AB01
303eil_C_DC11_DG12NANNANT01.30 BB04
313eil_D_DG2_DT3B-ABA01160.20 BA01
323eil_D_DT3_DT4BBBBB01350.40 BB01
333eil_D_DT4_DA5BBBBB00600.33 BB00
343eil_D_DA5_DA6BBBBB00840.18 BB00
353eil_D_DA6_DT7BBBBB00720.27 BB00
363eil_D_DT7_DT8BBBBB00590.25 BB00
373eil_D_DT8_DA9BBBBB00700.28 BB00
383eil_D_DA9_DA10BBBBB00280.25 BB00
393eil_D_DA10_DC11BBBBB00520.26 BB00
403eil_D_DC11_DG12NANNANT01.35 BB04
413eil_E_DG2_DT3B-ABA05200.46 BA05
423eil_E_DT3_DT4BBBBB01300.40 BB01
433eil_E_DT4_DA5miBBB15420.39 BB15
443eil_E_DA5_DA6BBBBB00550.24 BB00
453eil_E_DA6_DT7BBBBB00610.34 BB00
463eil_E_DT7_DT8BBBBB01810.16 BB01
473eil_E_DT8_DA9miBBB15590.35 BB15
483eil_E_DA9_DA10B-ABA05800.22 BA05
493eil_E_DA10_DC11BBBBB00130.25 BB00
503eil_E_DC11_DG12NANNANT01.30 BB04
513eil_F_DG2_DT3B-ABA05400.30 BA05
523eil_F_DT3_DT4BBBBB01400.46 BB01
533eil_F_DT4_DA5BBBBB00640.31 BB00
543eil_F_DA5_DA6BBBBB00740.21 BB00
553eil_F_DA6_DT7BBBBB00680.30 BB00
563eil_F_DT7_DT8BBBBB00670.24 BB00
573eil_F_DT8_DA9BBBBB00690.26 BB00
583eil_F_DA9_DA10BBBBB00550.25 BB00
593eil_F_DA10_DC11BBBBB00630.21 BB00
603eil_F_DC11_DG12NANNANT00.99 IC06

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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