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Conformers: ABBIImiBZICOPNSYNN
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CRYSTAL STRUCTURE OF HUMAN TOPOISOMERASE I DNA COMPLEX

Results of the assignment of 42 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
011ej9_C_DA1_DA2BBBBB00530.33 BB00
021ej9_C_DA2_DA3B12BB04840.22 BB04
031ej9_C_DA3_DA4B12BB04700.21 BB04
041ej9_C_DA4_DA5BBBBB00770.21 BB00
051ej9_C_DA5_DG6BBBBB00860.17 BB00
061ej9_C_DG6_DA7BBBBB00750.19 BB00
071ej9_C_DA7_DC8B12BB04260.37 BB04
081ej9_C_DC8_DT9B12BB04340.37 BB04
091ej9_C_DT9_DC10BBBBB00340.34 BB00
101ej9_C_DC10_DA11NANNANT00.89 BB07
111ej9_C_DA11_DG12B12BB04830.28 BB04
121ej9_C_DG12_DA13BBBBB00820.34 BB00
131ej9_C_DA13_DA14BBBBB00690.20 BB00
141ej9_C_DA14_DA15BBBBB00760.27 BB00
151ej9_C_DA15_DA16B12BB04490.27 BB04
161ej9_C_DA16_DA17BBBBB00540.31 BB00
171ej9_C_DA17_DT18BBwBB02800.16 BB02
181ej9_C_DT18_DT19BBBBB00460.28 BB00
191ej9_C_DT19_DT20BBBBB00740.18 BB00
201ej9_C_DT20_DT21BBwBB02430.30 BB02
211ej9_C_DT21_DT22BBBBB00260.32 BB00
221ej9_D_DA101_DA102BBwBB03290.47 BB03
231ej9_D_DA102_DA103BBBBB00650.33 BB00
241ej9_D_DA103_DA104BB2BB07340.30 BB07
251ej9_D_DA104_DA105miBBB10460.31 BB10
261ej9_D_DA105_DT106BBBBB00760.26 BB00
271ej9_D_DT106_DT107BBBBB00810.19 BB00
281ej9_D_DT107_DT108BBBBB00820.29 BB00
291ej9_D_DT108_DT109BBBBB00680.23 BB00
301ej9_D_DT109_DT110BBBBB00540.23 BB00
311ej9_D_DT110_DC111BBBBB00390.27 BB00
321ej9_D_DC111_DT112BBBBB00340.39 BB00
331ej9_D_DT112_DG113BB2BB07740.32 BB07
341ej9_D_DG113_DA114BBBBB00900.16 BB00
351ej9_D_DA114_DG115B12BB05560.24 BB05
361ej9_D_DG115_DT116BBwBB16590.58 BB16
371ej9_D_DT116_DC117BBBBB00670.26 BB00
381ej9_D_DC117_DT118BBBBB00610.42 BB00
391ej9_D_DT118_DT119B12BB04620.37 BB04
401ej9_D_DT119_DT120BBBBB00760.28 BB00
411ej9_D_DT120_DT121BBBBB00620.24 BB00
421ej9_D_DT121_DT122NANNANT00.56 BB07

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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