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Conformers: ABBIImiBZICOPNSYNN
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Crystal structure of liganded hRXR-alpha/hLXR-beta heterodimer on DNA

Results of the assignment of 68 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
014nqa_E_DT501_DA502BBwBB16600.45 BB16
024nqa_E_DA502_DA503NANNANT00.35 BA13
034nqa_E_DA503_DG504AAAAA00670.26 AA00
044nqa_E_DG504_DG505NANNANT00.43 AB04
054nqa_E_DG505_DT506BBBBB01390.21 BB01
064nqa_E_DT506_DC507BBBBB00580.47 BB00
074nqa_E_DC507_DA508NANNANT00.53 BB08
084nqa_E_DA508_DC509NANNANT00.59 BA10
094nqa_E_DC509_DT510AAAAA00490.33 AA00
104nqa_E_DT510_DT511AAAAA00730.31 AA00
114nqa_E_DT511_DC512NANNANT00.36 AB03
124nqa_E_DC512_DA513NANNANT00.32 BA13
134nqa_E_DA513_DG514NANNANT00.43 AB03
144nqa_E_DG514_DG515BBBBB01230.22 BB01
154nqa_E_DG515_DT516BBBBB01410.25 BB01
164nqa_E_DT516_DC517BBBBB00440.47 BB00
174nqa_E_DC517_DA518BB2BB07780.22 BB07
184nqa_F_DT501_DA502BBBBB00580.28 BB00
194nqa_F_DA502_DT503BBBBB01860.15 BB01
204nqa_F_DT503_DG504BBBBB00320.48 BB00
214nqa_F_DG504_DA505BB2BB07680.22 BB07
224nqa_F_DA505_DC506B-ABA05870.14 BA05
234nqa_F_DC506_DC507BBBBB01240.33 BB01
244nqa_F_DC507_DT508BBBBB00250.32 BB00
254nqa_F_DT508_DG509NANNANT00.53 BB10
264nqa_F_DG509_DA510B12BB04220.46 BB04
274nqa_F_DA510_DA511BBBBB00480.35 BB00
284nqa_F_DA511_DG512B-ABA05720.32 BA05
294nqa_F_DG512_DT513A-BAB03550.42 AB03
304nqa_F_DT513_DG514BBBBB00740.27 BB00
314nqa_F_DG514_DA515BB2BB07890.17 BB07
324nqa_F_DA515_DC516BBBBB00940.19 BB00
334nqa_F_DC516_DC517B12BB05820.21 BB05
344nqa_F_DC517_DT518NANNANT00.68 AB03
354nqa_L_DT501_DA502BBBBB00510.45 BB00
364nqa_L_DA502_DA503NANNANT00.33 BA13
374nqa_L_DA503_DG504AAAAA00650.25 AA00
384nqa_L_DG504_DG505A-BAB04360.40 AB04
394nqa_L_DG505_DT506BBBBB01220.25 BB01
404nqa_L_DT506_DC507BBBBB00560.43 BB00
414nqa_L_DC507_DA508BB2BB07790.18 BB07
424nqa_L_DA508_DC509B-ABA09490.47 BA09
434nqa_L_DC509_DT510AAAAA00740.34 AA00
444nqa_L_DT510_DT511A-BAB05740.25 AB05
454nqa_L_DT511_DC512BBBBB00630.38 BB00
464nqa_L_DC512_DA513B-ABA08820.28 BA08
474nqa_L_DA513_DG514A-BAB05420.20 AB05
484nqa_L_DG514_DG515BBBBB01310.16 BB01
494nqa_L_DG515_DT516BBBBB01390.17 BB01
504nqa_L_DT516_DC517BBBBB00440.42 BB00
514nqa_L_DC517_DA518BB2BB07870.29 BB07
524nqa_M_DT501_DA502B12BB04710.20 BB04
534nqa_M_DA502_DT503B-ABA05540.20 BA05
544nqa_M_DT503_DG504BBwBB16390.46 BB16
554nqa_M_DG504_DA505BB2BB07740.31 BB07
564nqa_M_DA505_DC506B-ABA05870.18 BA05
574nqa_M_DC506_DC507BBBBB01660.21 BB01
584nqa_M_DC507_DT508BBBBB01440.24 BB01
594nqa_M_DT508_DG509BBBBB01380.30 BB01
604nqa_M_DG509_DA510BB2BB07640.21 BB07
614nqa_M_DA510_DA511BBBBB00930.16 BB00
624nqa_M_DA511_DG512B12BB04210.17 BB04
634nqa_M_DG512_DT513BBBBB01360.23 BB01
644nqa_M_DT513_DG514BBBBB00560.32 BB00
654nqa_M_DG514_DA515BB2BB07690.24 BB07
664nqa_M_DA515_DC516BBBBB00820.32 BB00
674nqa_M_DC516_DC517B-ABA13420.42 BA13
684nqa_M_DC517_DT518A-BAB05400.21 AB05

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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