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Conformers: ABBIImiBZICOPNSYNN
Click the Summary/Torsions/Similar/... tabs for more details.
Isoreticular, interpenetrating co-crystal of Replication Initiator Protein REPE54 and scaffold duplex (21mer) containing the cognate REPE54 sequence and an insert duplex (10mer) with guest TAMRA-labelled thymine and G-C rich sequence.

Results of the assignment of 58 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
017uv6_A_DA0_DC1AAAAA00880.17 AA00
027uv6_A_DC1_DC2AAAAA00880.12 AA00
037uv6_A_DC2_DT3AAAAA00800.21 AA00
047uv6_A_DT3_DG4A-BAB05770.14 AB05
057uv6_A_DG4_DT5BBBBB00830.20 BB00
067uv6_A_DT5_DG6BBBBB00830.26 BB00
077uv6_A_DG6_DA7BBwBB02730.24 BB02
087uv6_A_DA7_DC8B-ABA05630.32 BA05
097uv6_A_DC8_DA9BBBBB00140.31 BB00
107uv6_A_DA9_DA10BBBBB00820.14 BB00
117uv6_A_DA10_DA11BBBBB01720.20 BB01
127uv6_A_DA11_DT12BBBBB01580.20 BB01
137uv6_A_DT12_DT13B-ABA05440.40 BA05
147uv6_A_DT13_DG14A-BAB01530.27 AB01
157uv6_A_DG14_DC15BBwBB02540.17 BB02
167uv6_A_DC15_DC16BBBBB01380.30 BB01
177uv6_A_DC16_DC17BBBBB00650.23 BB00
187uv6_A_DC17_DT18BBwBB02380.30 BB02
197uv6_A_DT18_DC19NANNANT00.40 BB15
207uv6_A_DC19_DA20BB2BB07730.23 BB07
217uv6_B_DT22_DC23BBBBB00150.34 BB00
227uv6_B_DC23_DT24BBwBB02770.23 BB02
237uv6_B_DT24_DG25BBBBB00640.32 BB00
247uv6_B_DG25_DA26BB2BB07760.28 BB07
257uv6_B_DA26_DG27B-ABA10840.16 BA10
267uv6_B_DG27_DG28AAAAA00870.24 AA00
277uv6_B_DG28_DG29AAwAA01770.15 AA01
287uv6_B_DG29_DC30AAAAA00740.29 AA00
297uv6_B_DC30_DA31A-BAB05560.30 AB05
307uv6_B_DA31_DA32BBBBB00770.19 BB00
317uv6_B_DA32_DT33BBwBB02820.16 BB02
327uv6_B_DT33_DT34BBBBB00600.21 BB00
337uv6_B_DT34_DT35BBBBB00810.22 BB00
347uv6_B_DT35_DG36BBBBB00860.24 BB00
357uv6_B_DG36_DT37BBBBB01710.20 BB01
367uv6_B_DT37_DC38BBBBB00400.24 BB00
377uv6_B_DC38_DA39B12BB04840.16 BB04
387uv6_B_DA39_DC40B-ABA05840.19 BA05
397uv6_B_DC40_DA41BBBBB00450.36 BB00
407uv6_B_DA41_DG42BBBBB00620.31 BB00
417uv6_E_DG21_DA22BBBBB00860.19 BB00
427uv6_E_DA22_DC23BBBBB00580.20 BB00
437uv6_E_DC23_DG24BBBBB00220.30 BB00
447uv6_E_DG24_DG25BB2BB08880.36 BB08
457uv6_E_DG25_DC26BBBBB00810.25 BB00
467uv6_E_DC26_DC27NANNANT00.39 BA08
477uv6_E_DC27_DC28B-ABA08630.27 BA08
487uv6_E_DC28_DG29A-BAB01730.29 AB01
497uv6_E_DG29_DG30NANNANT00.32 BB15
507uv6_F_DG12_DT13A-BAB01160.36 AB01
517uv6_F_DT13_DC14BBBBB00630.22 BB00
527uv6_F_DC14_DC15NANNANT00.46 BB04
537uv6_F_DC15_DG16BBBBB00180.44 BB00
547uv6_F_DG16_DG17BBwBB02470.42 BB02
557uv6_F_DG17_DG18NANNANT00.44 BB10
567uv6_F_DG18_DC19NANNANT00.34 BA17
577uv6_F_DC19_DC20BBBBB00430.29 BB00
587uv6_F_DC20_DG21miBBB10360.34 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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