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Conformers: ABBIImiBZICOPNSYNN
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Aminofluorene DNA adduct at the pre-insertion site of a DNA polymerase

Results of the assignment of 19 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
011ua0_B_DG21_DG22B-ABA01580.29 BA01
021ua0_B_DG22_DG23A-BAB01860.24 AB01
031ua0_B_DG23_DA24BBBBB00890.18 BB00
041ua0_B_DA24_DT25B-ABA01890.21 BA01
051ua0_B_DT25_DG26A-BAB01860.34 AB01
061ua0_B_DG26_DG27B-ABA08790.29 BA08
071ua0_B_DG27_DT28AAAAA00810.23 AA00
081ua0_B_DT28_DG29A-BAB05810.22 AB05
091ua0_C_DT2_DG3NANNANT00.87 AB2S
101ua0_C_DG3_DC4NANNANT00.94 OPS1
111ua0_C_DC4_DA5AAAAA00790.25 AA00
121ua0_C_DA5_DC6AAwAA01930.16 AA01
131ua0_C_DC6_DC7A-BAB05810.25 AB05
141ua0_C_DC7_DA8BBBBB00650.32 BB00
151ua0_C_DA8_DT9BBBBB00900.21 BB00
161ua0_C_DT9_DC10B-ABA01560.20 BA01
171ua0_C_DC10_DC11NANNANT00.47 AA01
181ua0_C_DC11_DC12BBBBB00620.46 BB00
191ua0_C_DC12_DT13B12BB04900.22 BB04

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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