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Conformers: ABBIImiBZICOPNSYNN
Click the Summary/Torsions/Similar/... tabs for more details.
Complex structure of Sulfolobus solfataricus DPO4 and DNA duplex containing a hydrophobic thymine isostere 2,4-difluorotoluene nucleotide in the template strand

Results of the assignment of 52 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
012v9w_C_DG1_DG2NANNANT00.82 OP24
022v9w_C_DG2_DG3BBBBB00900.16 BB00
032v9w_C_DG3_DG4BBBBB00700.39 BB00
042v9w_C_DG4_DG5BBBBB00860.17 BB00
052v9w_C_DG5_DA6BBBBB00880.20 BB00
062v9w_C_DA6_DA7BBBBB00640.35 BB00
072v9w_C_DA7_DG8BBBBB00630.32 BB00
082v9w_C_DG8_DG9BBBBB00800.22 BB00
092v9w_C_DG9_DA10BBBBB00790.24 BB00
102v9w_C_DA10_DC11BBBBB00830.26 BB00
112v9w_C_DC11_DT12NANNANT00.42 BB02
122v9w_C_DT12_DG13NANNANT01.01 BB16
132v9w_D_DT1_DT.A2NANNANT00.90 BB03
142v9w_D_DT.A2_DC.A3NANNANT01.03 BB2S
152v9w_D_DC.A3_DA4NANNANT01.11 BB1S
162v9w_D_DA4_DG5NANNANT00.83 OP15
172v9w_D_DA7_DG8BBBBB00220.37 BB00
182v9w_D_DG8_DT9B12BB04730.20 BB04
192v9w_D_DT9_DC10B12BB04550.33 BB04
202v9w_D_DC10_DC11miBBB10690.40 BB10
212v9w_D_DC11_DT12BBBBB00940.15 BB00
222v9w_D_DT12_DT13B12BB04770.25 BB04
232v9w_D_DT13_DC14BBBBB00780.35 BB00
242v9w_D_DC14_DC15B12BB04770.17 BB04
252v9w_D_DC15_DC16BBBBB00930.19 BB00
262v9w_D_DC16_DC17B12BB04730.30 BB04
272v9w_D_DC17_DC18BB2BB08560.38 BB08
282v9w_E_DG1_DG2BBBBB00840.17 BB00
292v9w_E_DG2_DG3B12BB04330.31 BB04
302v9w_E_DG3_DG4B12BB05500.47 BB05
312v9w_E_DG4_DG5BBBBB00360.43 BB00
322v9w_E_DG5_DA6BBBBB00680.31 BB00
332v9w_E_DA6_DA7B12BB04770.24 BB04
342v9w_E_DA7_DG8BBBBB00660.28 BB00
352v9w_E_DG8_DG9BBBBB00840.14 BB00
362v9w_E_DG9_DA10B12BB04560.25 BB04
372v9w_E_DA10_DC11BBBBB00740.33 BB00
382v9w_E_DC11_DT12BBBBB00140.48 BB00
392v9w_E_DT12_DG13NANNANT00.85 BB13
402v9w_F_DC.A3_DA4NANNANT01.15 BB2S
412v9w_F_DA4_DG5NANNANT00.76 AA13
422v9w_F_DA7_DG8BBwBB02620.27 BB02
432v9w_F_DG8_DT9BBBBB00580.28 BB00
442v9w_F_DT9_DC10B12BB04640.27 BB04
452v9w_F_DC10_DC11BBwBB02550.29 BB02
462v9w_F_DC11_DT12BBBBB00870.23 BB00
472v9w_F_DT12_DT13BBBBB00590.34 BB00
482v9w_F_DT13_DC14B12BB04740.26 BB04
492v9w_F_DC14_DC15BBBBB00740.28 BB00
502v9w_F_DC15_DC16BBBBB00390.56 BB00
512v9w_F_DC16_DC17NANNANT00.55 AB02
522v9w_F_DC17_DC18BB2BB07680.40 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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