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Conformers: ABBIImiBZICOPNSYNN
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Crystal structure of a bacterial quorum-sensing transcription factor complexed with pheromone and DNA

Results of the assignment of 76 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
011l3l_E_DG1_DA2BBBBB00850.22 BB00
021l3l_E_DA2_DT3BBwBB02780.15 BB02
031l3l_E_DT3_DG4BBBBB00810.23 BB00
041l3l_E_DG4_DT5BBBBB00860.25 BB00
051l3l_E_DT5_DG6BBwBB02830.15 BB02
061l3l_E_DG6_DC7BBBBB00830.22 BB00
071l3l_E_DC7_DA8BB2BB07910.19 BB07
081l3l_E_DA8_DG9BBBBB00890.17 BB00
091l3l_E_DG9_DA10BBBBB00760.31 BB00
101l3l_E_DA10_DT11BBwBB02740.20 BB02
111l3l_E_DT11_DC12BBBBB00850.26 BB00
121l3l_E_DC12_DT13BBBBB00930.14 BB00
131l3l_E_DT13_DG14BBBBB00970.15 BB00
141l3l_E_DG14_DC15BBwBB02830.20 BB02
151l3l_E_DC15_DA16BBBBB00840.19 BB00
161l3l_E_DA16_DC17BBwBB02980.00 BB02
171l3l_E_DC17_DA18BBBBB00790.15 BB00
181l3l_E_DA18_DT19BBBBB00840.19 BB00
191l3l_E_DT19_DC20BBBBB00730.26 BB00
201l3l_F_DG101_DA102BBBBB00900.19 BB00
211l3l_F_DA102_DT103BBBBB00410.27 BB00
221l3l_F_DT103_DG104BBBBB00750.29 BB00
231l3l_F_DG104_DT105BBBBB00840.26 BB00
241l3l_F_DT105_DG106BBwBB02520.23 BB02
251l3l_F_DG106_DC107BBBBB00810.20 BB00
261l3l_F_DC107_DA108BB2BB07960.20 BB07
271l3l_F_DA108_DG109BBBBB00860.17 BB00
281l3l_F_DG109_DA110BBBBB00750.32 BB00
291l3l_F_DA110_DT111BBwBB02690.22 BB02
301l3l_F_DT111_DC112BBBBB00860.25 BB00
311l3l_F_DC112_DT113BBBBB00890.17 BB00
321l3l_F_DT113_DG114BBBBB00970.16 BB00
331l3l_F_DG114_DC115BBBBB00690.23 BB00
341l3l_F_DC115_DA116BBwBB02620.31 BB02
351l3l_F_DA116_DC117BBBBB00520.37 BB00
361l3l_F_DC117_DA118BBBBB00760.26 BB00
371l3l_F_DA118_DT119BBBBB00850.18 BB00
381l3l_F_DT119_DC120BBBBB00780.23 BB00
391l3l_G_DG1_DA2BBBBB00860.17 BB00
401l3l_G_DA2_DT3BBBBB01920.20 BB01
411l3l_G_DT3_DG4BBBBB00710.24 BB00
421l3l_G_DG4_DT5BBBBB00760.34 BB00
431l3l_G_DT5_DG6BBBBB00850.24 BB00
441l3l_G_DG6_DC7BBwBB02670.17 BB02
451l3l_G_DC7_DA8B12BB04170.28 BB04
461l3l_G_DA8_DG9BBBBB00830.20 BB00
471l3l_G_DG9_DA10BBBBB00740.27 BB00
481l3l_G_DA10_DT11BBBBB01780.24 BB01
491l3l_G_DT11_DC12BBBBB00500.39 BB00
501l3l_G_DC12_DT13BBBBB00890.15 BB00
511l3l_G_DT13_DG14BBBBB00960.18 BB00
521l3l_G_DG14_DC15BBBBB00610.25 BB00
531l3l_G_DC15_DA16BBBBB00780.22 BB00
541l3l_G_DA16_DC17BBBBB00850.19 BB00
551l3l_G_DC17_DA18BBBBB00590.29 BB00
561l3l_G_DA18_DT19BBwBB02770.24 BB02
571l3l_G_DT19_DC20BBBBB00690.31 BB00
581l3l_H_DG101_DA102BBBBB00850.16 BB00
591l3l_H_DA102_DT103BBBBB00860.22 BB00
601l3l_H_DT103_DG104BBBBB00790.21 BB00
611l3l_H_DG104_DT105BBwBB02340.33 BB02
621l3l_H_DT105_DG106BBBBB00520.41 BB00
631l3l_H_DG106_DC107NANNANT00.44 BB02
641l3l_H_DC107_DA108BBBBB00650.41 BB00
651l3l_H_DA108_DG109BBBBB00740.25 BB00
661l3l_H_DG109_DA110BBBBB00640.33 BB00
671l3l_H_DA110_DT111BBBBB01750.24 BB01
681l3l_H_DT111_DC112BBBBB00460.40 BB00
691l3l_H_DC112_DT113BBBBB00890.15 BB00
701l3l_H_DT113_DG114BBBBB00970.15 BB00
711l3l_H_DG114_DC115BBwBB02640.30 BB02
721l3l_H_DC115_DA116BBBBB00850.21 BB00
731l3l_H_DA116_DC117BBBBB00910.18 BB00
741l3l_H_DC117_DA118BBBBB00570.34 BB00
751l3l_H_DA118_DT119BBBBB00840.23 BB00
761l3l_H_DT119_DC120BBBBB00900.16 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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