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Conformers: ABBIImiBZICOPNSYNN
Click the Summary/Torsions/Similar/... tabs for more details.
PURINE REPRESSOR MUTANT-HYPOXANTHINE-PALINDROMIC OPERATOR COMPLEX

Results of the assignment of 16 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
011qqa_M_DT699_DA700BBBBB00150.36 BB00
021qqa_M_DA700_DC701NANNANT00.66 BB17
031qqa_M_DC701_DG702NANNANT00.45 BB00
041qqa_M_DG702_DC703NANNANT00.30 BB15
051qqa_M_DC703_DA704NANNANT00.46 BB15
061qqa_M_DA704_DA705BB2BB07100.23 BB07
071qqa_M_DA705_DG706B12BB04640.30 BB04
081qqa_M_DG706_DC707B-ABA08470.38 BA08
091qqa_M_DC707_DG708NANNANT00.64 AB03
101qqa_M_DG708_DC709NANNANT00.21 BB05
111qqa_M_DC709_DT710NANNANT00.59 BB16
121qqa_M_DT710_DT711miBBB15460.36 BB15
131qqa_M_DT711_DG712BB2BB07770.27 BB07
141qqa_M_DG712_DC713NANNANT00.50 BB05
151qqa_M_DC713_DG714BBwBB02220.39 BB02
161qqa_M_DG714_DT715BBBBB00220.33 BB00

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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