A: Myosin A tail domain interacting protein MTIP B: Myosin A tail domain interacting protein MTIP C: Myosin A tail domain interacting protein MTIP D: Myosin-A E: Myosin-A F: Myosin-A
Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength
Wavelength: 0.97939 Å / Relative weight: 1
Reflection
Resolution: 2.29→41.7 Å / Num. all: 1 / Num. obs: 26831 / % possible obs: 99.34 %
Reflection shell
Resolution: 2.29→2.34 Å / Redundancy: 7.3 % / Rmerge(I) obs: 0.083 / Mean I/σ(I) obs: 23.5
-
Processing
Software
Name
Version
Classification
HKL-2000
datacollection
PHASER
phasing
REFMAC
5.6.0117
refinement
HKL-2000
datareduction
HKL-2000
datascaling
Refinement
Method to determine structure: MOLECULAR REPLACEMENT / Resolution: 2.29→41.7 Å / Cor.coef. Fo:Fc: 0.937 / Cor.coef. Fo:Fc free: 0.895 / SU B: 14.974 / SU ML: 0.189 / Cross valid method: THROUGHOUT / ESU R: 0.302 / ESU R Free: 0.246 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.27942
1338
5 %
RANDOM
Rwork
0.22577
-
-
-
obs
0.22836
25424
99.34 %
-
Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK
Displacement parameters
Biso mean: 52.848 Å2
Baniso -1
Baniso -2
Baniso -3
1-
0.02 Å2
0 Å2
0 Å2
2-
-
-0.04 Å2
0 Å2
3-
-
-
0.02 Å2
Refinement step
Cycle: LAST / Resolution: 2.29→41.7 Å
Protein
Nucleic acid
Ligand
Solvent
Total
Num. atoms
3420
0
0
191
3611
Refine LS restraints
Refine-ID
Type
Dev ideal
Dev ideal target
Number
X-RAY DIFFRACTION
r_bond_refined_d
0.008
0.02
3467
X-RAY DIFFRACTION
r_bond_other_d
0.002
0.02
3263
X-RAY DIFFRACTION
r_angle_refined_deg
1.184
1.954
4646
X-RAY DIFFRACTION
r_angle_other_deg
0.793
3.002
7421
X-RAY DIFFRACTION
r_dihedral_angle_1_deg
5.501
5
416
X-RAY DIFFRACTION
r_dihedral_angle_2_deg
35.643
24.807
181
X-RAY DIFFRACTION
r_dihedral_angle_3_deg
15.067
15
670
X-RAY DIFFRACTION
r_dihedral_angle_4_deg
20.238
15
23
X-RAY DIFFRACTION
r_chiral_restr
0.07
0.2
508
X-RAY DIFFRACTION
r_gen_planes_refined
0.004
0.02
3918
X-RAY DIFFRACTION
r_gen_planes_other
0.001
0.02
797
LS refinement shell
Resolution: 2.287→2.346 Å / Total num. of bins used: 20
Rfactor
Num. reflection
% reflection
Rfree
0.364
89
-
Rwork
0.292
1592
-
obs
-
-
93.34 %
Refinement TLS params.
Method: refined / Refine-ID: X-RAY DIFFRACTION
ID
L11 (°2)
L12 (°2)
L13 (°2)
L22 (°2)
L23 (°2)
L33 (°2)
S11 (Å °)
S12 (Å °)
S13 (Å °)
S21 (Å °)
S22 (Å °)
S23 (Å °)
S31 (Å °)
S32 (Å °)
S33 (Å °)
T11 (Å2)
T12 (Å2)
T13 (Å2)
T22 (Å2)
T23 (Å2)
T33 (Å2)
Origin x (Å)
Origin y (Å)
Origin z (Å)
1
9.6998
8.4408
0.777
11.3738
4.1853
3.1232
-0.2962
1.0202
0.3691
-1.8984
0.2562
0.1936
-1.4379
-0.5527
0.0401
1.3487
0.3163
-0.2507
0.5439
0.1599
0.4099
-23.7787
33.8065
-40.8683
2
11.2495
-5.7788
-1.7882
8.2878
3.8189
4.6549
0.18
1.0949
0.2021
-1.4107
-0.5767
0.3255
-0.9828
-0.3641
0.3967
0.8553
0.1
-0.1211
0.2276
0.0597
0.1135
-20.8514
24.6507
-39.8646
3
7.3949
-0.5898
1.2549
4.6229
3.7866
7.9486
-0.0476
0.2044
-0.4683
-0.7176
-0.1061
0.3771
-0.618
-0.4291
0.1537
0.3293
0.066
-0.0919
0.1734
-0.0162
0.1105
-21.7468
16.4134
-34.439
4
11.9564
-3.8737
0.6731
11.8672
1.5844
4.6273
-0.5365
0.7333
-0.394
-1.191
-0.1831
0.9836
-1.1555
-0.2379
0.7196
0.6608
0.2944
-0.3158
0.6269
-0.1735
0.3008
-30.9351
18.4466
-40.4841
5
0.8116
-0.5774
0.1831
20.3368
-1.3824
8.452
0.1429
-0.0091
0.3569
-0.6157
-0.1317
0.8284
-1.2954
-0.8093
-0.0112
0.7343
0.3287
-0.2133
0.4418
-0.0404
0.3657
-29.2798
25.9463
-34.1403
6
4.6607
-1.0231
-2.621
6.0166
1.1122
5.5349
-0.1556
0.0604
-0.0564
-0.6936
-0.2284
0.1389
-0.0677
-0.3532
0.384
0.1601
0.036
-0.0518
0.1315
-0.0123
0.1429
-20.52
16.9273
-25.1279
7
17.6198
-3.0188
7.2638
38.139
7.4918
14.8129
-0.405
-0.9052
-0.5041
0.3596
-0.0289
0.4725
0.2732
-0.5224
0.434
0.0427
0.0171
0.0774
0.2829
0.127
0.1996
-10.5901
8.1613
-22.0753
8
13.3518
-4.8481
-6.5892
12.2113
-5.2128
14.8988
-0.5556
-0.1156
-1.6008
-0.1543
-0.205
0.6716
1.1459
-0.0338
0.7606
0.2468
-0.0074
0.1268
0.2716
0.0338
0.3884
-8.2783
1.2254
-27.2431
9
28.1856
-10.5333
22.3894
12.4009
-17.7467
28.1842
1.3723
-0.2417
-1.1925
-1.0016
-0.9669
-0.0301
1.6628
1.0424
-0.4054
0.5591
0.2949
0.1776
0.71
0.2399
0.6556
-1.396
-2.8384
-24.5254
10
6.9011
-0.7155
0.4377
3.1266
-3.3819
7.5039
-0.1731
-0.079
0.0868
-0.1106
-0.1239
-0.1654
0.1551
0.7247
0.297
0.1662
-0.0155
0.1121
0.3344
0.0542
0.2837
0.663
4.1074
-32.6486
11
4.5662
-0.3368
3.3206
1.9541
1.9969
5.108
-0.0238
0.0934
-0.246
0.0467
-0.1221
0.2065
0.0515
-0.1861
0.1459
0.1814
-0.0487
0.0612
0.2354
-0.0391
0.2368
-9.5973
5.834
-38.622
12
23.5866
-9.8545
14.9176
19.6849
-7.1437
18.8077
0.0029
0.5785
0.4349
-1.0711
-0.5427
-0.7025
-0.8167
1.3161
0.5398
0.3093
-0.1876
0.1363
0.2855
0.0322
0.2226
-2.2674
12.2686
-41.5715
13
5.3103
-4.5448
-0.1431
4.7108
0.4612
13.0291
-0.3044
-0.1384
0.1366
-0.1087
0.1857
-0.1355
-1.2442
1.0411
0.1188
0.3625
-0.2683
0.0175
0.4484
0.0826
0.229
2.9174
14.7878
-32.6406
14
26.67
0.3006
-17.233
2.6481
-1.2899
18.9931
-0.157
-0.6711
0.1335
-0.1154
0.1348
-0.7512
-0.3316
1.4224
0.0221
0.1095
-0.0543
0.0548
0.4704
0.0777
0.2965
3.3263
7.2891
-26.0765
15
5.0119
3.0053
1.3367
2.7283
3.6283
8.987
0.0971
-0.1877
-0.0363
-0.255
0.0396
-0.0771
-0.8893
0.3369
-0.1367
0.2369
-0.0656
-0.0116
0.3212
-0.0011
0.2678
-5.367
15.7528
-24.9616
16
8.4204
6.0646
-3.6164
23.4222
4.7866
4.4316
0.8628
-0.4132
0.7806
0.1461
-0.7491
1.7228
-0.7554
0.0265
-0.1137
1.0182
0.4522
-0.2449
0.3413
-0.1039
0.7382
-30.5546
40.4743
-19.7109
17
6.4142
-1.6932
3.1783
10.1233
-3.545
6.8016
0.0512
0.2917
0.9638
-0.9311
-0.5408
0.093
-1.5474
0.1034
0.4896
0.8435
0.1022
-0.0951
0.1348
-0.0169
0.3593
-21.7298
43.5382
-21.7989
18
9.3844
0.5301
5.1392
5.8996
1.4151
9.0972
0.1693
-0.3208
0.5323
-0.673
-0.0396
0.306
-0.6242
-0.1575
-0.1297
0.2227
0.03
-0.0121
0.1239
-0.03
0.1989
-20.479
32.6512
-15.4218
19
15.0629
4.8659
16.8013
4.8646
5.2264
18.7546
-0.2614
1.076
-0.0211
-2.0885
0.2425
-0.7289
-0.176
1.2308
0.0189
1.2428
0.013
0.3656
0.3948
0.0433
0.4702
-10.191
35.6837
-22.9814
20
7.1466
0.4319
0.5162
6.9686
0.3057
4.203
0.0278
0.401
0.5801
-1.5955
-0.1261
-0.0906
-1.0871
0.2308
0.0983
0.9484
0.1297
-0.0054
0.1307
0.0898
0.2031
-19.3419
38.7042
-28.755
21
3.1593
1.7989
-3.945
26.9867
1.1899
5.4758
0.1155
0.0423
-0.1623
-0.6495
-0.0565
-0.8189
-0.242
0.1168
-0.059
0.4432
0.0664
-0.0928
0.3753
-0.1474
0.3211
-17.8731
28.8067
-23.4362
22
3.1306
6.5275
12.5478
14.3678
27.3754
52.269
0.2159
0.1897
-0.3181
0.3889
0.0375
0.0375
0.9887
0.5725
-0.2534
0.8034
0.2199
-0.2247
0.478
0.0417
0.8598
-10.1663
20.8169
-14.7632
23
13.8727
15.8049
11.596
18.8772
12.0252
12.9887
0.132
0.7283
-0.864
-0.4885
0.7471
-1.3716
0.8873
1.2996
-0.879
0.4837
0.0896
0.1494
0.4109
-0.1368
0.6243
-1.8119
23.654
-8.2388
24
7.493
8.2863
6.9287
85.6038
-9.9464
10.468
0.4341
0.9662
-1.3317
0.3323
0.7382
-1.5415
0.3179
0.9744
-1.1723
0.2747
0.1793
0.0096
0.7084
-0.3582
0.7662
5.4632
26.1426
-2.1212
25
10.3627
2.1895
6.2163
1.4091
-1.0499
9.6328
0.3195
-0.4434
-1.328
-0.0641
-0.1649
-0.5293
0.5328
-0.1094
-0.1546
0.7295
0.012
-0.204
0.3897
-0.106
0.6115
0.0041
24.6685
4.263
26
1.3331
-0.3299
3.3724
6.952
1.486
10.4687
-0.0406
-0.0819
0.1909
0.1423
0.3663
-0.8724
-0.2081
0.3776
-0.3257
0.0277
-0.0544
0.0582
0.3344
-0.1519
0.4683
-1.9779
36.0454
-3.6451
27
25.7324
-0.032
0.6474
25.1783
-12.0418
36.6538
-0.1928
-0.8878
1.9846
0.8656
0.1037
0.6204
-0.9723
-0.9871
0.0891
0.0525
0.0201
0.0476
0.2431
-0.119
0.3682
-9.9028
40.8833
-2.8504
28
0.8146
-2.6851
-0.2866
20.1588
-1.3238
3.1272
-0.1564
-0.4712
0.0493
0.4446
0.3734
0.1741
0.4912
-0.6476
-0.217
0.2115
-0.122
0.0051
0.828
-0.0361
0.324
-12.2764
32.27
3.3036
29
15.532
-5.1186
-8.618
8.5017
9.5711
11.4937
0.3388
-0.6752
-0.3912
2.0075
0.1521
-0.5014
1.9164
0.1703
-0.4909
0.6674
-0.0546
-0.2242
0.3808
0.1114
0.3049
-5.655
24.2294
4.269
30
11.7343
-9.548
7.6828
8.7188
-1.1207
34.4234
0.3543
-0.2522
-0.9856
0.2052
0.029
0.7844
2.1913
-1.0985
-0.3833
0.422
-0.1738
-0.106
0.2711
0.0286
0.4248
-12.9181
23.421
-4.9834
31
28.8204
-31.2227
-12.2365
36.4333
16.4114
9.018
0.5301
1.4961
-0.6093
-0.9321
-0.5522
0.4273
-0.7498
0.5657
0.0221
0.6867
0.1301
-0.2528
0.7423
-0.0224
0.4863
-38.9675
24.3369
-31.169
32
22.8875
-20.9531
-3.3409
19.219
2.9936
0.6097
0.133
0.1392
-1.0405
-0.1312
-0.0422
1.0871
0.0153
-0.2085
-0.0908
0.4041
0.1646
-0.2284
0.5931
0.0933
0.7333
-44.2579
27.9081
-24.58
33
2.8292
0.1512
1.7112
6.17
-3.4203
4.4942
0.006
-0.0817
0.1027
0.4232
-0.0424
0.707
-0.3707
-0.7252
0.0364
0.2144
0.1304
-0.0989
0.432
-0.1485
0.3523
-37.9036
19.667
-20.0606
34
4.1649
-1.4939
-0.7204
7.0856
2.2432
4.4477
-0.093
-0.2122
0.3039
0.0675
-0.1549
0.3386
-0.4741
-0.462
0.2479
0.1371
0.1391
-0.1168
0.2284
-0.0733
0.2742
-32.377
21.8532
-14.6013
35
5.5497
-0.4357
-0.9894
1.2781
0.5406
6.0362
-0.1699
0.0015
0.4298
-0.3428
-0.0261
0.3662
-0.5476
-0.4696
0.1961
0.2827
0.2128
-0.1904
0.2414
-0.0825
0.398
-36.1715
30.712
-19.9447
36
5.3369
0.3455
0.3437
2.6876
2.6863
2.6899
0.0276
-0.1857
0.2661
-0.3368
-0.1335
0.1385
-0.3314
-0.144
0.1059
0.2008
0.1284
-0.1352
0.2008
-0.0403
0.27
-27.5155
24.3215
-18.1991
37
4.3467
2.8952
1.9705
23.6075
-14.1624
15.3726
0.2348
-0.5009
0.1794
0.6398
-0.7421
-0.914
-0.3456
0.4727
0.5073
0.0654
-0.0122
-0.0532
0.2601
0.0154
0.2386
-18.3244
11.342
-10.3794
38
14.714
4.9559
10.3215
18.9473
-2.9364
9.7232
0.1983
-1.2997
-0.0711
1.2665
-0.3086
-0.623
-0.4895
-0.9077
0.1103
0.3739
-0.1181
0.0146
0.424
0.0629
0.3025
-23.7285
5.158
-1.3623
39
13.0597
-4.9059
-18.68
1.8438
7.0258
26.809
-0.9537
-1.0337
-0.2368
0.3341
0.3686
0.1137
1.1315
1.4513
0.5852
0.6453
0.0033
-0.5925
0.8505
0.0972
0.8149
-21.795
-2.251
2.047
40
0.6708
0.5134
1.1229
5.6467
-2.2207
3.7895
0.0779
-0.2296
-0.0679
0.0928
-0.1573
-0.0937
0.0864
-0.2457
0.0795
0.1363
-0.0407
-0.0151
0.3987
0.1021
0.399
-29.9683
-2.1342
-5.2964
41
3.8854
1.0998
4.1162
3.3421
1.4995
10.5892
0.1886
-0.3237
-0.122
0.5628
0.0208
0.4257
-0.1025
-0.6243
-0.2094
0.1597
-0.0166
0.0084
0.4002
-0.075
0.2754
-36.6358
7.0575
-6.1623
42
6.8446
-4.4593
-0.2434
8.334
-0.3262
4.7974
0.0642
0.1235
-0.509
-0.2912
-0.161
0.4103
0.3538
-0.3977
0.0968
0.0531
-0.0463
-0.0478
0.1967
-0.0227
0.2366
-33.169
-2.0378
-15.3495
43
34.6741
12.6787
1.4508
21.2603
0.9878
0.1349
0.687
-0.3441
-2.019
-0.1019
-0.6474
-1.2849
0.2728
0.0377
-0.0397
1.1178
0.2033
-0.0015
0.28
0.1028
0.3656
-25.449
-8.2437
-9.6838
44
8.4296
-1.1426
-5.019
10.5631
-3.0075
4.2995
0.2322
-0.2663
-0.2587
0.2295
-0.6881
-0.7966
-0.2058
0.4503
0.4559
0.1547
0.0641
-0.0557
0.3315
0.1363
0.3382
-21.4872
0.5974
-10.6008
45
11.0493
6.1972
-1.0836
28.3532
-3.8867
20.3273
0.009
0.7548
-0.2805
-0.9242
-0.5796
-0.6983
0.6414
0.4688
0.5707
0.0886
0.0689
-0.0297
0.2495
0.0603
0.2834
-21.5149
4.8391
-17.9163
46
3.4382
-1.3874
0.4852
4.0016
2.9834
3.0064
-0.0368
0.0006
-0.1041
-0.2671
-0.0095
0.0953
-0.2634
-0.0308
0.0464
0.1865
-0.0271
0.0124
0.201
0.0169
0.1304
-12.0902
12.1845
-32.5372
47
8.5325
-4.6126
-1.3525
7.0777
0.0345
16.7162
-0.0752
0.4052
1.13
-0.0123
-0.3001
-0.7203
-1.8024
0.6749
0.3753
0.5117
-0.1657
-0.0402
0.3309
0.0454
0.3535
-7.7329
22.4541
-33.9234
48
7.6436
0.6583
2.9815
6.0297
-1.2958
3.7041
0.2791
0.3708
0.1597
-0.5816
0.0004
-0.5292
0.3053
0.3197
-0.2794
0.1555
-0.0288
0.0371
0.2612
-0.0425
0.2387
-9.0288
31.1872
-10.9518
49
11.9906
1.68
-1.5181
29.3719
-0.5423
16.1078
0.0478
-1.0163
0.261
0.5683
0.1441
0.4749
-0.286
-0.566
-0.1919
0.1332
-0.096
-0.0221
0.3304
-0.0063
0.2425
-19.2753
32.7565
-6.943
50
3.3634
1.8594
-0.9533
5.0631
-3.3009
9.9314
0.1004
-0.1663
0.0176
0.2334
-0.0607
0.0802
-0.1407
-0.0656
-0.0397
0.0206
0.0325
-0.0169
0.163
-0.0279
0.1715
-29.1765
10.7657
-11.6863
51
17.547
-6.7959
7.6327
16.3553
1.6002
17.3177
0.117
1.663
-0.2593
-1.5018
-0.121
0.4506
0.2418
-0.2665
0.004
0.2819
-0.017
-0.0439
0.3912
-0.0399
0.3103
-31.351
8.2814
-22.318
Refinement TLS group
ID
Refine-ID
Refine TLS-ID
Auth asym-ID
Auth seq-ID
1
X-RAY DIFFRACTION
1
A
79 - 87
2
X-RAY DIFFRACTION
2
A
90 - 101
3
X-RAY DIFFRACTION
3
A
102 - 114
4
X-RAY DIFFRACTION
4
A
115 - 122
5
X-RAY DIFFRACTION
5
A
123 - 130
6
X-RAY DIFFRACTION
6
A
131 - 140
7
X-RAY DIFFRACTION
7
A
141 - 145
8
X-RAY DIFFRACTION
8
A
146 - 150
9
X-RAY DIFFRACTION
9
A
151 - 156
10
X-RAY DIFFRACTION
10
A
157 - 167
11
X-RAY DIFFRACTION
11
A
168 - 175
12
X-RAY DIFFRACTION
12
A
176 - 181
13
X-RAY DIFFRACTION
13
A
182 - 189
14
X-RAY DIFFRACTION
14
A
190 - 196
15
X-RAY DIFFRACTION
15
A
197 - 204
16
X-RAY DIFFRACTION
16
B
79 - 84
17
X-RAY DIFFRACTION
17
B
85 - 97
18
X-RAY DIFFRACTION
18
B
98 - 106
19
X-RAY DIFFRACTION
19
B
107 - 114
20
X-RAY DIFFRACTION
20
B
115 - 129
21
X-RAY DIFFRACTION
21
B
130 - 136
22
X-RAY DIFFRACTION
22
B
137 - 141
23
X-RAY DIFFRACTION
23
B
142 - 148
24
X-RAY DIFFRACTION
24
B
149 - 153
25
X-RAY DIFFRACTION
25
B
154 - 161
26
X-RAY DIFFRACTION
26
B
162 - 174
27
X-RAY DIFFRACTION
27
B
175 - 179
28
X-RAY DIFFRACTION
28
B
180 - 189
29
X-RAY DIFFRACTION
29
B
190 - 197
30
X-RAY DIFFRACTION
30
B
198 - 204
31
X-RAY DIFFRACTION
31
C
80 - 83
32
X-RAY DIFFRACTION
32
C
84 - 90
33
X-RAY DIFFRACTION
33
C
91 - 100
34
X-RAY DIFFRACTION
34
C
101 - 116
35
X-RAY DIFFRACTION
35
C
117 - 128
36
X-RAY DIFFRACTION
36
C
129 - 136
37
X-RAY DIFFRACTION
37
C
137 - 145
38
X-RAY DIFFRACTION
38
C
146 - 150
39
X-RAY DIFFRACTION
39
C
151 - 155
40
X-RAY DIFFRACTION
40
C
156 - 169
41
X-RAY DIFFRACTION
41
C
170 - 177
42
X-RAY DIFFRACTION
42
C
178 - 189
43
X-RAY DIFFRACTION
43
C
190 - 194
44
X-RAY DIFFRACTION
44
C
195 - 199
45
X-RAY DIFFRACTION
45
C
200 - 204
46
X-RAY DIFFRACTION
46
D
803 - 812
47
X-RAY DIFFRACTION
47
D
813 - 817
48
X-RAY DIFFRACTION
48
E
803 - 812
49
X-RAY DIFFRACTION
49
E
813 - 817
50
X-RAY DIFFRACTION
50
F
803 - 812
51
X-RAY DIFFRACTION
51
F
813 - 817
+
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