Home or other PDB ID
 
 
 
 
 
 
 
 
 
Selection mode
 
 
 
 
 
 
Conformers: ABBIImiBZICOPNSYNN
Click the Summary/Torsions/Similar/... tabs for more details.
Crystal structure of an E. coli thi-box riboswitch bound to benfotiamine

Results of the assignment of 68 detected steps in 1 model(s), can be also downloaded as csv or json file. Average confal 0, percentile 0.

Your browser does not support the HTML5 canvas tag.
Your browser does not support the HTML5 canvas tag.
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
012hoo_A_G9_C10AAAAA00870.16 AA00
022hoo_A_C10_G11AAAAA00790.13 AA00
032hoo_A_G11_A12AAAAA00740.17 AA00
042hoo_A_A12_C13AAAAA00770.15 AA00
052hoo_A_C13_U14AAAAA00620.13 AA00
062hoo_A_U14_C15AAAAA00710.22 AA00
072hoo_A_C15_G16AAAAA00560.35 AA00
082hoo_A_G16_G17AAAAA00740.21 AA00
092hoo_A_G17_G18AAAAA00930.17 AA00
102hoo_A_G18_G19AAAAA00260.35 AA00
112hoo_A_G19_U20NANNANT00.31 AA06
122hoo_A_U20_G21NANNANT01.55 OP24
132hoo_A_G21_C22AAAAA00390.37 AA00
142hoo_A_C22_C23AAAAA00860.20 AA00
152hoo_A_C23_C24AAAAA00790.36 AA00
162hoo_A_C24_U25NANNANT01.16 AA13
172hoo_A_G29_C30AAAAA00180.60 AA00
182hoo_A_A34_A35AAAAA08460.50 AA08
192hoo_A_A35_G36AAAAA08730.35 AA08
202hoo_A_G36_G37AAAAA08760.18 AA08
212hoo_A_G37_C38AAAAA08310.35 AA08
222hoo_A_C38_U39AAAAA08600.34 AA08
232hoo_A_U39_G40AAAAA00270.38 AA00
242hoo_A_G40_A41OPNOP04850.13 OP04
252hoo_A_A41_G42AAAAA08470.28 AA08
262hoo_A_G42_A43NANNANT00.60 AB04
272hoo_A_A43_A44NANNANT01.65 OP31
282hoo_A_A44_A45NANNANT01.67 AA06
292hoo_A_A47_C48AAAAA08730.32 AA08
302hoo_A_C48_C49AAAAA08910.12 AA08
312hoo_A_C49_C50AAAAA00830.20 AA00
322hoo_A_C50_G51AAAAA00330.25 AA00
332hoo_A_G51_U52NANNANT00.58 OP01
342hoo_A_U52_A53NANNANT01.56 AA01
352hoo_A_A53_U54NANNANT01.11 OP29
362hoo_A_A56_C57AAAAA08310.60 AA08
372hoo_A_C57_C58AAAAA00790.21 AA00
382hoo_A_C58_U59AAAAA00770.26 AA00
392hoo_A_U59_G60AAAAA00590.34 AA00
402hoo_A_G60_A61NANNANT00.44 ZZ01
412hoo_A_C63_U64AAAAA00570.40 AA00
422hoo_A_U64_G65AAAAA00530.30 AA00
432hoo_A_G65_G66AAAAA00680.24 AA00
442hoo_A_G66_A67AAwAA01180.31 AA01
452hoo_A_A67_U68AAAAA08360.28 AA08
462hoo_A_U68_A69OPNOP04680.19 OP04
472hoo_A_A69_A70AAAAA00670.27 AA00
482hoo_A_A70_U71AAAAA00360.23 AA00
492hoo_A_U71_G72NANNANT00.58 OP29
502hoo_A_G72_C73NANNANT01.92 AA13
512hoo_A_C73_C74AAAAA00380.29 AA00
522hoo_A_C74_A75AAAAA08840.28 AA08
532hoo_A_A75_G76AAAAA00170.34 AA00
542hoo_A_G76_C77AAAAA00520.31 AA00
552hoo_A_C77_G78NANNANT00.43 ZZ01
562hoo_A_G78_U79NANNANT01.73 OP17
572hoo_A_U79_A80NANNANT01.45 OP29
582hoo_A_A80_G81AAAAA08380.40 AA08
592hoo_A_G81_G82AAAAA00560.22 AA00
602hoo_A_G82_G83AAAAA00250.41 AA00
612hoo_A_G83_A84AAuAA07400.34 AA07
622hoo_A_A84_A85NANNANT00.50 IC07
632hoo_A_A85_G86B-ABA10620.33 BA10
642hoo_A_G86_U87AAAAA00560.09 AA00
652hoo_A_U87_C88AAAAA00930.10 AA00
662hoo_A_C88_G89AAAAA00820.25 AA00
672hoo_A_G89_C90AAAAA03610.28 AA03
682hoo_A_C90_A91NANNANT01.11 OP01

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).

Browse conformers

Return up to random steps in PDB structures ( include large structures )

Show




Color by conformation group (pyramids)

group
visible

Color by NtC (balls)

A

A-B

B-A

B

IC

OPN

Z

N