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Conformers: ABBIImiBZICOPNSYNN
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Crystal Structure of MBD4 Catalytic Domain Bound to Abasic DNA

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
014dk9_B_DA1_DA2NANNANT00.97 BB17
024dk9_B_DA2_DG3NANNANT00.76 BB12
034dk9_B_DG3_DA4BBBBB00270.48 BB00
044dk9_B_DA4_DC5B-ABA08310.32 BA08
054dk9_B_DC5_DG6NANNANT01.85 OP19
064dk9_B_DG6_DT7B-ABA17790.41 BA17
074dk9_B_DT7_DG8A-BAB03420.32 AB03
084dk9_B_DG8_DG9B12BB04310.18 BB04
094dk9_B_DG9_DA10BBBBB00850.16 BB00
104dk9_B_DA10_DC11NANNANT00.48 BB10
114dk9_C_DT12_DG13BBBBB0070.69 BB00
124dk9_C_DG13_DT14BBBBB00600.23 BB00
134dk9_C_DT14_DC15B12BB04390.36 BB04
144dk9_C_DC15_DC16BBBBB0080.20 BB00
154dk9_C_DC16_DA17BB2BB07670.23 BB07
164dk9_C_DG19_DT20B-ABA05650.27 BA05
174dk9_C_DT20_DC21B-ABA05610.47 BA05
184dk9_C_DC21_DT22NANNANT00.35 AB03

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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