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Conformers: ABBIImiBZICOPNSYNN
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CRYSTAL STRUCTURE OF POLYAMIDE DIMER (IMPYHPPYBETADP)2 BOUND TO B-DNA DECAMER CCAGATCTGG

Results of the assignment of 18 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
011cvx_A_DC1_DC2BBBBB00110.48 BB00
021cvx_A_DC2_DA3BB2BB07290.34 BB07
031cvx_A_DA3_DG4BBBBB00660.19 BB00
041cvx_A_DG4_DA5BB2BB07710.34 BB07
051cvx_A_DA5_DT6BBBBB00820.17 BB00
061cvx_A_DT6_DC7BBwBB02600.26 BB02
071cvx_A_DC7_DT8BBBBB00690.31 BB00
081cvx_A_DT8_DG9BB2BB07510.35 BB07
091cvx_A_DG9_DG10B12BB04350.32 BB04
101cvx_B_DC1_DC2BBBBB00390.55 BB00
111cvx_B_DC2_DA3BB2BB07740.18 BB07
121cvx_B_DA3_DG4BBBBB00810.26 BB00
131cvx_B_DG4_DA5BB2BB07850.30 BB07
141cvx_B_DA5_DT6BBBBB00620.19 BB00
151cvx_B_DT6_DC7BBwBB02120.37 BB02
161cvx_B_DC7_DT8BBBBB00560.35 BB00
171cvx_B_DT8_DG9BB2BB07540.19 BB07
181cvx_B_DG9_DG10NANNANT00.44 BB13

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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