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Conformers: ABBIImiBZICOPNSYNN
Click the Summary/Torsions/Similar/... tabs for more details.
Crystal structure of Staphylococcus aureus Cas9 in complex with sgRNA and target DNA (TTGGGT PAM)

Results of the assignment of 108 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
0015axw_B_G1_G2AAAAA00850.12 AA00
0025axw_B_G2_A3AAAAA00270.34 AA00
0035axw_B_A3_A4AAAAA00840.12 AA00
0045axw_B_A4_A5AAAAA00880.16 AA00
0055axw_B_A5_U6AAAAA00540.30 AA00
0065axw_B_U6_U7AAAAA00910.10 AA00
0075axw_B_U7_A8AAAAA00940.10 AA00
0085axw_B_A8_G9AAAAA00870.12 AA00
0095axw_B_G9_G10AAAAA00680.24 AA00
0105axw_B_G10_U11AAAAA00830.14 AA00
0115axw_B_U11_G12AAAAA00900.16 AA00
0125axw_B_G12_C13AAAAA00880.09 AA00
0135axw_B_C13_G14AAAAA00830.19 AA00
0145axw_B_G14_C15AAAAA00820.22 AA00
0155axw_B_C15_U16AAAAA00820.20 AA00
0165axw_B_U16_U17AAwAA10950.20 AA10
0175axw_B_U17_G18AAAAA08740.27 AA08
0185axw_B_G18_G19AAAAA08930.18 AA08
0195axw_B_G19_C20AAwAA01810.19 AA01
0205axw_B_C20_G21AAAAA00320.47 AA00
0215axw_B_G21_U22AAAAA08790.18 AA08
0225axw_B_U22_U23AAAAA00760.23 AA00
0235axw_B_U23_U24AAAAA00730.16 AA00
0245axw_B_U24_U25AAAAA08870.16 AA08
0255axw_B_U25_A26AAAAA00890.14 AA00
0265axw_B_A26_G27AAAAA00980.08 AA00
0275axw_B_G27_U28AAAAA00980.08 AA00
0285axw_B_U28_A29AAAAA08840.17 AA08
0295axw_B_A29_C30AAAAA08800.20 AA08
0305axw_B_C30_U31AAAAA00600.25 AA00
0315axw_B_U31_C32AAAAA00880.16 AA00
0325axw_B_C32_U33AAAAA00830.15 AA00
0335axw_B_U33_G34AAAAA00840.14 AA00
0345axw_B_G34_G35AAAAA00850.18 AA00
0355axw_B_G35_A36OPNOP03800.15 OP03
0365axw_B_A36_A37AAAAA08920.25 AA08
0375axw_B_A37_A38AAAAA00710.25 AA00
0385axw_B_A38_C39AAAAA08200.69 AA08
0395axw_B_C39_A40AAAAA00900.12 AA00
0405axw_B_A40_G41AAAAA00850.10 AA00
0415axw_B_G41_A42AAAAA00890.14 AA00
0425axw_B_A42_A43AAAAA00800.19 AA00
0435axw_B_A43_U44A-BAB05810.21 AB05
0445axw_B_U44_C45NANNANT00.69 OP26
0455axw_B_C45_U46AAAAA08780.25 AA08
0465axw_B_U46_A47AAAAA00820.15 AA00
0475axw_B_A47_C48AAAAA08850.24 AA08
0485axw_B_C48_U49AAAAA00940.13 AA00
0495axw_B_U49_A50AAAAA00940.14 AA00
0505axw_B_A50_A51AAAAA00940.15 AA00
0515axw_B_A51_A52AAAAA00950.10 AA00
0525axw_B_A52_A53AAAAA00830.19 AA00
0535axw_B_A53_C54AAAAA00910.18 AA00
0545axw_B_C54_A55NANNANT02.09 OP31
0555axw_B_A55_A56NANNANT00.83 OPS1
0565axw_B_A56_G57NANNANT00.90 AA08
0575axw_B_G57_G58AAAAA00710.26 AA00
0585axw_B_G58_C59AAwAA01640.21 AA01
0595axw_B_C59_A60AAAAA08150.60 AA08
0605axw_B_A60_A61NANNANT00.53 AA11
0615axw_B_A61_A62NANNANT01.28 OP22
0625axw_B_A62_A63NANNANT02.00 BB17
0635axw_B_A63_U64NANNANT00.41 OP13
0645axw_B_U64_G65NANNANT01.48 OP05
0655axw_B_G65_C66AAAAA00570.24 AA00
0665axw_B_C66_C67AAAAA00690.24 AA00
0675axw_B_C67_G68AAAAA00940.15 AA00
0685axw_B_G68_U69NANNANT00.84 IC02
0695axw_B_U69_G70OPNOP11880.28 OP11
0705axw_B_G70_U71AAAAA00900.14 AA00
0715axw_B_U71_U72AAAAA08570.20 AA08
0725axw_C_DC1_DT2A-BAB05710.20 AB05
0735axw_C_DT2_DA3BBBBB00880.25 BB00
0745axw_C_DA3_DC4B-ABA09550.20 BA09
0755axw_C_DC4_DC5AAAAA08760.25 AA08
0765axw_C_DC5_DC6NANNANT00.51 AB04
0775axw_C_DC6_DA7A-BAB03830.23 AB03
0785axw_C_DA7_DA8B12BB04810.15 BB04
0795axw_C_DA8_DG9NANNANT00.51 OP17
0805axw_C_DG9_DC10BBBBB0090.57 BB00
0815axw_C_DC10_DC11B-ABA13470.21 BA13
0825axw_C_DC11_DA.A12AAAAA00710.26 AA00
0835axw_C_DC11_DA.B12NANNANT00.59 AA06
0845axw_C_DA.A12_DA.A13AAAAA00380.36 AA00
0855axw_C_DA.B12_DA.B13NANNANT01.55 OP24
0865axw_C_DA.A13_DG14NANNANT00.33 AA06
0875axw_C_DA.B13_DG14NANNANT00.36 AA01
0885axw_C_DG14_DC15AAAAA08210.28 AA08
0895axw_C_DC15_DG16AAAAA00780.25 AA00
0905axw_C_DG16_DC17AAAAA08860.19 AA08
0915axw_C_DC17_DA18AAAAA00950.11 AA00
0925axw_C_DA18_DC19AAAAA00910.16 AA00
0935axw_C_DC19_DC20AAAAA00920.16 AA00
0945axw_C_DC20_DT21AAAAA00920.17 AA00
0955axw_C_DT21_DA22AAAAA00850.18 AA00
0965axw_C_DA22_DA23AAAAA00860.17 AA00
0975axw_C_DA23_DT24AAAAA00830.21 AA00
0985axw_C_DT24_DT25AAAAA00600.29 AA00
0995axw_C_DT25_DT26AAAAA00520.27 AA00
1005axw_C_DT26_DC27A-BAB01210.34 AB01
1015axw_C_DC27_DC28BBBBB00410.41 BB00
1025axw_D_DT1_DT2BBBBB00670.24 BB00
1035axw_D_DT2_DG3BB2BB08460.29 BB08
1045axw_D_DG3_DG4BBBBB00210.49 BB00
1055axw_D_DG4_DG5BB2BB07380.24 BB07
1065axw_D_DG5_DT6BBBBB00460.32 BB00
1075axw_D_DT6_DA7BBBBB00720.26 BB00
1085axw_D_DA7_DG8BBBBB01790.21 BB01

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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