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Conformers: ABBIImiBZICOPNSYNN
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CRYSTAL STRUCTURE OF THERMUS THERMOPHILUS VALYL-TRNA SYNTHETASE COMPLEXED WITH TRNA(VAL) AND VALYL-ADENYLATE ANALOGUE

Results of the assignment of 148 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
0011gax_C_G901_G902AAwAA01260.25 AA01
0021gax_C_G902_G903AAwAA06320.47 AA06
0031gax_C_G903_C904AAAAA08680.21 AA08
0041gax_C_C904_G905AAAAA00750.14 AA00
0051gax_C_G905_G906AAAAA00970.14 AA00
0061gax_C_G906_C907NANNANT00.46 AB03
0071gax_C_C907_U908NANNANT00.59 OP11
0081gax_C_U908_A909NANNANT01.11 IC03
0091gax_C_A909_G910NANNANT01.59 OP25
0101gax_C_G910_C911NANNANT00.69 AA12
0111gax_C_C911_U912AAAAA00780.18 AA00
0121gax_C_U912_C913AAwAA01780.23 AA01
0131gax_C_C913_A914AAwAA01240.42 AA01
0141gax_C_A914_G915AAAAA08490.51 AA08
0151gax_C_G915_C916NANNANT00.59 AB04
0161gax_C_C916_G917NANNANT01.89 OP21
0171gax_C_G917_G918NANNANT01.07 BB17
0181gax_C_G918_A919NANNANT01.53 IC04
0191gax_C_A919_A920NANNANT01.23 OP17
0201gax_C_A920_G921NANNANT01.04 AA01
0211gax_C_G921_A922AAAAA00840.19 AA00
0221gax_C_A922_G923AAAAA00640.15 AA00
0231gax_C_G923_C924AAAAA08900.17 AA08
0241gax_C_C924_G925AAAAA00850.26 AA00
0251gax_C_G925_C926AAAAA00830.28 AA00
0261gax_C_C926_U927AAAAA00540.28 AA00
0271gax_C_U927_C928AAAAA00830.15 AA00
0281gax_C_C928_G929NANNANT00.49 AA03
0291gax_C_G929_C930AAwAA01520.27 AA01
0301gax_C_C930_C931NANNANT01.04 IC03
0311gax_C_C931_U932NANNANT02.43 OP16
0321gax_C_U932_C933NANNANT01.07 OP03
0331gax_C_C933_A934NANNANT01.14 OP30
0341gax_C_A934_C935AAAAA00670.23 AA00
0351gax_C_C935_A936NANNANT01.49 OP30
0361gax_C_A936_C937NANNANT00.71 OP21
0371gax_C_C937_G938NANNANT01.50 OP01
0381gax_C_G938_C939AAAAA00540.26 AA00
0391gax_C_C939_G940AAAAA00870.14 AA00
0401gax_C_G940_A941AAAAA00930.19 AA00
0411gax_C_A941_G942AAwAA10630.19 AA10
0421gax_C_G942_A943AAAAA00730.15 AA00
0431gax_C_A943_G944AAAAA00270.44 AA00
0441gax_C_G944_G945NANNANT00.73 IC07
0451gax_C_G945_U946NANNANT00.46 OP29
0461gax_C_U946_C947NANNANT01.18 OP06
0471gax_C_C947_G948NANNANT02.02 OP14
0481gax_C_G948_U949AAAAA08240.35 AA08
0491gax_C_U949_A950AAAAA00840.14 AA00
0501gax_C_A950_G951AAwAA01500.24 AA01
0511gax_C_G951_G952NANNANT00.53 AA10
0521gax_C_G952_U953NANNANT00.67 AA12
0531gax_C_U953_U954AAAAA00690.30 AA00
0541gax_C_U954_C955OPNOP04850.31 OP04
0551gax_C_C955_A956AAAAA00290.50 AA00
0561gax_C_A956_A957NANNANT00.72 AB04
0571gax_C_A957_G958NANNANT01.38 OP18
0581gax_C_G958_U959NANNANT00.97 AAS1
0591gax_C_U959_C960NANNANT00.33 OP12
0601gax_C_C960_C961AAAAA00710.20 AA00
0611gax_C_C961_U962AAAAA00600.29 AA00
0621gax_C_U962_A963AAwAA06720.15 AA06
0631gax_C_A963_C964AAAAA08930.17 AA08
0641gax_C_C964_G965AAAAA00780.14 AA00
0651gax_C_G965_C966AAwAA11900.15 AA11
0661gax_C_C966_C967AAAAA08200.46 AA08
0671gax_C_C967_G968AAAAA00660.22 AA00
0681gax_C_G968_C969AAwAA01760.27 AA01
0691gax_C_C969_C970AAAAA08930.19 AA08
0701gax_C_C970_C971AAAAA00870.10 AA00
0711gax_C_C971_A972NANNANT00.92 AA11
0721gax_C_A972_C973NANNANT00.43 OP03
0731gax_C_C973_C974NANNANT01.12 OP29
0741gax_C_C974_A975NANNANT01.86 IC03
0751gax_D_G901_G902AAwAA01420.28 AA01
0761gax_D_G902_G903NANNANT00.69 AA11
0771gax_D_G903_C904AAwAA01600.25 AA01
0781gax_D_C904_G905AAAAA00600.24 AA00
0791gax_D_G905_G906AAAAA00860.20 AA00
0801gax_D_G906_C907NANNANT00.47 AB03
0811gax_D_C907_U908NANNANT00.65 OP11
0821gax_D_U908_A909NANNANT01.22 IC03
0831gax_D_A909_G910NANNANT01.60 OP25
0841gax_D_G910_C911AAAAA00600.22 AA00
0851gax_D_C911_U912AAAAA00780.24 AA00
0861gax_D_U912_C913AAwAA01700.22 AA01
0871gax_D_C913_A914AAwAA10400.35 AA10
0881gax_D_A914_G915AAAAA08430.52 AA08
0891gax_D_G915_C916NANNANT00.61 AB04
0901gax_D_C916_G917NANNANT01.78 OP18
0911gax_D_G917_G918NANNANT00.39 IC04
0921gax_D_G918_A919NANNANT01.66 OP07
0931gax_D_A919_A920NANNANT01.40 OP17
0941gax_D_A920_G921NANNANT01.15 AA11
0951gax_D_G921_A922AAAAA08670.28 AA08
0961gax_D_A922_G923AAAAA00780.16 AA00
0971gax_D_G923_C924AAAAA08860.15 AA08
0981gax_D_C924_G925AAAAA00850.26 AA00
0991gax_D_G925_C926AAAAA00860.24 AA00
1001gax_D_C926_U927AAAAA00320.36 AA00
1011gax_D_U927_C928AAAAA00770.17 AA00
1021gax_D_C928_G929AAAAA00690.23 AA00
1031gax_D_G929_C930AAwAA01590.32 AA01
1041gax_D_C930_C931NANNANT01.22 OP11
1051gax_D_C931_U932NANNANT02.25 OP16
1061gax_D_U932_C933NANNANT01.29 OP03
1071gax_D_C933_A934NANNANT01.08 OP30
1081gax_D_A934_C935AAAAA00600.20 AA00
1091gax_D_C935_A936NANNANT00.75 IC02
1101gax_D_A936_C937NANNANT00.77 OP21
1111gax_D_C937_G938NANNANT01.56 OP01
1121gax_D_G938_C939AAAAA00130.33 AA00
1131gax_D_C939_G940AAAAA00450.23 AA00
1141gax_D_G940_A941AAAAA00870.22 AA00
1151gax_D_A941_G942AAwAA01900.14 AA01
1161gax_D_G942_A943AAAAA00820.13 AA00
1171gax_D_A943_G944AAAAA08640.36 AA08
1181gax_D_G944_G945NANNANT00.58 IC03
1191gax_D_G945_U946NANNANT01.41 OP17
1201gax_D_U946_C947NANNANT01.05 OP06
1211gax_D_C947_G948NANNANT01.44 OP05
1221gax_D_G948_U949AAAAA00470.25 AA00
1231gax_D_U949_A950AAAAA00650.20 AA00
1241gax_D_A950_G951AAwAA01430.29 AA01
1251gax_D_G951_G952NANNANT00.51 AA10
1261gax_D_G952_U953AAAAA08330.38 AA08
1271gax_D_U953_U954AAAAA00840.21 AA00
1281gax_D_U954_C955OPNOP03430.35 OP03
1291gax_D_C955_A956AAAAA00540.39 AA00
1301gax_D_A956_A957NANNANT01.15 AA07
1311gax_D_A957_G958NANNANT01.72 OP02
1321gax_D_G958_U959NANNANT00.91 AAS1
1331gax_D_U959_C960NANNANT00.43 OP12
1341gax_D_C960_C961AAAAA00300.35 AA00
1351gax_D_C961_U962AAAAA00420.27 AA00
1361gax_D_U962_A963AAwAA01360.34 AA01
1371gax_D_A963_C964AAAAA08490.31 AA08
1381gax_D_C964_G965AAAAA08750.26 AA08
1391gax_D_G965_C966AAwAA11770.20 AA11
1401gax_D_C966_C967AAAAA08310.35 AA08
1411gax_D_C967_G968AAAAA00840.22 AA00
1421gax_D_G968_C969AAwAA01750.34 AA01
1431gax_D_C969_C970AAAAA08940.24 AA08
1441gax_D_C970_C971AAAAA00710.13 AA00
1451gax_D_C971_A972AAAAA00580.35 AA00
1461gax_D_A972_C973NANNANT00.58 OP03
1471gax_D_C973_C974NANNANT01.19 OP29
1481gax_D_C974_A975NANNANT01.81 IC03

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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