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Conformers: ABBIImiBZICOPNSYNN
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SOLUTION STRUCTURES OF THE I-MOTIF TETRAMERS OF D(TCC), D(5MCCT) AND D(T5MCC). NOVEL NOE CONNECTIONS BETWEEN AMINO PROTONS AND SUGAR PROTONS

Results of the assignment of 64 detected steps in 8 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
01105d-m1_A_DT1_DC2NANNANT00.97 IC06
02105d-m2_A_DT1_DC2NANNANT00.70 BB11
03105d-m3_A_DT1_DC2NANNANT00.86 IC07
04105d-m4_A_DT1_DC2NANNANT00.71 AA02
05105d-m5_A_DT1_DC2NANNANT00.68 AA10
06105d-m6_A_DT1_DC2NANNANT00.53 AA12
07105d-m7_A_DT1_DC2NANNANT00.70 AA07
08105d-m8_A_DT1_DC2NANNANT00.85 IC07
09105d-m1_A_DC2_DC3NANNANT00.44 IC04
10105d-m2_A_DC2_DC3NANNANT00.42 IC04
11105d-m3_A_DC2_DC3NANNANT00.39 IC04
12105d-m4_A_DC2_DC3NANNANT00.51 IC04
13105d-m5_A_DC2_DC3NANNANT00.67 IC04
14105d-m6_A_DC2_DC3NANNANT00.59 IC04
15105d-m7_A_DC2_DC3NANNANT00.47 IC04
16105d-m8_A_DC2_DC3NANNANT00.47 IC04
17105d-m1_B_DT4_DC5NANNANT00.73 AA06
18105d-m2_B_DT4_DC5NANNANT00.71 BB11
19105d-m3_B_DT4_DC5NANNANT00.76 AA02
20105d-m4_B_DT4_DC5NANNANT00.67 AA02
21105d-m5_B_DT4_DC5NANNANT00.56 AA02
22105d-m6_B_DT4_DC5NANNANT00.58 AA07
23105d-m7_B_DT4_DC5NANNANT00.58 AA12
24105d-m8_B_DT4_DC5NANNANT00.77 AA07
25105d-m1_B_DC5_DC6NANNANT00.51 IC04
26105d-m2_B_DC5_DC6NANNANT00.91 IC06
27105d-m3_B_DC5_DC6NANNANT00.41 IC04
28105d-m4_B_DC5_DC6NANNANT00.96 IC07
29105d-m5_B_DC5_DC6NANNANT00.57 IC04
30105d-m6_B_DC5_DC6NANNANT00.41 IC04
31105d-m7_B_DC5_DC6NANNANT00.40 IC04
32105d-m8_B_DC5_DC6NANNANT00.48 IC04
33105d-m1_C_DT7_DC8NANNANT00.62 AA13
34105d-m2_C_DT7_DC8NANNANT00.57 AA02
35105d-m3_C_DT7_DC8NANNANT00.69 AA13
36105d-m4_C_DT7_DC8NANNANT00.68 AA02
37105d-m5_C_DT7_DC8NANNANT00.63 AA07
38105d-m6_C_DT7_DC8NANNANT00.62 AA13
39105d-m7_C_DT7_DC8NANNANT00.73 AA02
40105d-m8_C_DT7_DC8NANNANT00.78 AA07
41105d-m1_C_DC8_DC9NANNANT00.75 IC06
42105d-m2_C_DC8_DC9NANNANT00.74 IC06
43105d-m3_C_DC8_DC9NANNANT00.81 IC06
44105d-m4_C_DC8_DC9NANNANT00.82 IC06
45105d-m5_C_DC8_DC9NANNANT00.48 IC04
46105d-m6_C_DC8_DC9NANNANT00.43 IC04
47105d-m7_C_DC8_DC9NANNANT00.44 IC04
48105d-m8_C_DC8_DC9NANNANT00.47 IC04
49105d-m1_D_DT10_DC11NANNANT00.73 AA07
50105d-m2_D_DT10_DC11NANNANT00.82 IC07
51105d-m3_D_DT10_DC11NANNANT00.76 IC04
52105d-m4_D_DT10_DC11NANNANT00.76 BB04
53105d-m5_D_DT10_DC11NANNANT00.67 AA02
54105d-m6_D_DT10_DC11NANNANT00.61 AA02
55105d-m7_D_DT10_DC11NANNANT00.66 AB04
56105d-m8_D_DT10_DC11NANNANT00.81 IC07
57105d-m1_D_DC11_DC12NANNANT00.41 IC04
58105d-m2_D_DC11_DC12NANNANT00.46 IC04
59105d-m3_D_DC11_DC12NANNANT00.47 IC04
60105d-m4_D_DC11_DC12NANNANT00.47 IC04
61105d-m5_D_DC11_DC12NANNANT00.59 IC04
62105d-m6_D_DC11_DC12NANNANT01.96 OP19
63105d-m7_D_DC11_DC12NANNANT00.51 IC04
64105d-m8_D_DC11_DC12NANNANT00.86 IC06

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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