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Conformers: ABBIImiBZICOPNSYNN
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DNA Adduct Bypass Polymerization by Sulfolobus solfataricus Dpo4. Analysis and Crystal Structures of Multiple Base-Pair Substitution and Frameshift Products with the Adduct 1,N2-Ethenoguanine

Results of the assignment of 28 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
012bqu_P_DG1_DG2miBBB10540.23 BB10
022bqu_P_DG2_DG3B12BB04800.26 BB04
032bqu_P_DG3_DG4BBBBB00680.32 BB00
042bqu_P_DG4_DG5B12BB04200.30 BB04
052bqu_P_DG5_DA6B12BB04620.26 BB04
062bqu_P_DA6_DA7BBBBB00770.20 BB00
072bqu_P_DA7_DG8BBBBB00920.23 BB00
082bqu_P_DG8_DG9BBBBB00780.28 BB00
092bqu_P_DG9_DA10BBBBB00770.24 BB00
102bqu_P_DA10_DT11BBwBB02880.17 BB02
112bqu_P_DT11_DT12BBBBB00770.17 BB00
122bqu_P_DT12_DC13BBBBB00780.20 BB00
132bqu_T_DC2_DA3NANNANT00.57 BB2S
142bqu_T_DA3_DT4NANNANT00.66 OP28
152bqu_T_DT4_GNE5B-ABA05160.39 BA05
162bqu_T_GNE5_DG6NANNANT00.59 BA17
172bqu_T_DG6_DA7BBBBB00840.19 BB00
182bqu_T_DA7_DA8B12BB04380.26 BB04
192bqu_T_DA8_DT9BBBBB00760.16 BB00
202bqu_T_DT9_DC10BBBBB00540.22 BB00
212bqu_T_DC10_DC11BBBBB00560.26 BB00
222bqu_T_DC11_DT12BBBBB00930.12 BB00
232bqu_T_DT12_DT13BBBBB00930.11 BB00
242bqu_T_DT13_DC14NANNANT00.40 BB02
252bqu_T_DC14_DC15BBBBB00590.40 BB00
262bqu_T_DC15_DC16B12BB04800.19 BB04
272bqu_T_DC16_DC17BBBBB00690.31 BB00
282bqu_T_DC17_DC18B12BB04840.25 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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