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Conformers: ABBIImiBZICOPNSYNN
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ANALYSIS OF A MUTATIONAL HOT-SPOT IN THE ECORV RESTRICTION ENDONUCLEASE: A CATALYTIC ROLE FOR A MAIN CHAIN CARBONYL GROUP

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
011b95_C_DA1_DA2SYNBBS1280.40 BBS1
021b95_C_DA2_DA3BBBBB00330.28 BB00
031b95_C_DA3_DG4BBBBB00570.23 BB00
041b95_C_DG4_DA5B-ABA16910.17 BA16
051b95_C_DA5_DT6AAAAA00490.23 AA00
061b95_C_DT6_DA7A-BAB04700.16 AB04
071b95_C_DA7_DT8BBBBB01600.24 BB01
081b95_C_DT8_DC9BBBBB00340.33 BB00
091b95_C_DC9_DT10BBBBB00790.22 BB00
101b95_C_DT10_DT11miBBB15150.37 BB15
111b95_D_DA1_DA2SYNBBS1790.32 BBS1
121b95_D_DA2_DA3B-ABA05590.25 BA05
131b95_D_DA3_DG4A-BAB03320.25 AB03
141b95_D_DG4_DA5B-ABA16910.17 BA16
151b95_D_DA5_DT6AAAAA00670.20 AA00
161b95_D_DT6_DA7A-BAB04790.12 AB04
171b95_D_DA7_DT8BBBBB01660.21 BB01
181b95_D_DT8_DC9BBBBB01500.31 BB01
191b95_D_DC9_DT10A-BAB03830.28 AB03
201b95_D_DT10_DT11NANNANT00.52 BB10

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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