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Conformers: ABBIImiBZICOPNSYNN
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STRUCTURAL AND ENERGETIC ORIGINS OF INDIRECT READOUT IN SITE-SPECIFIC DNA CLEAVAGE BY A RESTRICTION ENDONUCLEASE

Results of the assignment of 20 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
011bua_C_DA901_DA902NANNANT00.44 BBS1
021bua_C_DA902_DA903BBBBB00830.15 BB00
031bua_C_DA903_DG904BBBBB00830.19 BB00
041bua_C_DG904_DA905NANNANT00.35 BB08
051bua_C_DA905_DC906NANNANT00.62 BB16
061bua_C_DC906_DI907NANNANT00.23 AB04
071bua_C_DI907_DT908BBBBB00830.25 BB00
081bua_C_DT908_DC909BBBBB00600.30 BB00
091bua_C_DC909_DT910BBBBB00800.19 BB00
101bua_C_DT910_DT911miBBB15130.38 BB15
111bua_D_DA801_DA802SYNBBS1710.33 BBS1
121bua_D_DA802_DA803BBBBB00640.23 BB00
131bua_D_DA803_DG804BBBBB00670.22 BB00
141bua_D_DG804_DA805B-ABA16340.25 BA16
151bua_D_DA805_DC806NANNANT00.37 AB04
161bua_D_DC806_DI807A-BAB04400.20 AB04
171bua_D_DI807_DT808BBBBB00820.21 BB00
181bua_D_DT808_DC809BBBBB00550.30 BB00
191bua_D_DC809_DT810BBBBB00680.21 BB00
201bua_D_DT810_DT811B12BB04780.17 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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