## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
A |
65 |
21 |
6025 |
◊ |
B |
-x,y-1/2,-z+5/2 |
3_547 |
59 |
14 |
5722 |
525.5 |
-3.6 |
0.419 |
11 |
5 |
0 |
0.100 |
2 |
2 |
|
B |
58 |
15 |
5722 |
◊ |
A |
x,y,z |
1_555 |
63 |
16 |
6025 |
491.2 |
2.9 |
0.848 |
11 |
0 |
0 |
0.037 |
3 |
3 |
|
D |
46 |
8 |
1212 |
◊ |
B |
x,y,z |
1_555 |
66 |
20 |
5722 |
435.5 |
-9.3 |
0.216 |
3 |
0 |
0 |
0.581 |
4 |
|
C |
44 |
7 |
1216 |
◊ |
A |
x,y,z |
1_555 |
67 |
20 |
6025 |
428.0 |
-8.9 |
0.228 |
5 |
0 |
0 |
0.581 |
Average: |
431.7 |
-9.1 |
0.222 |
4 |
0 |
0 |
0.581 |
4 |
5 |
|
B |
40 |
12 |
5722 |
◊ |
A |
x-1,y,z |
1_455 |
35 |
9 |
6025 |
351.1 |
-1.3 |
0.557 |
5 |
0 |
0 |
0.000 |
5 |
6 |
|
A |
20 |
9 |
6025 |
◊ |
A |
x,-y+1,-z+2 |
2_567 |
20 |
9 |
6025 |
236.3 |
0.2 |
0.651 |
6 |
0 |
0 |
0.000 |
6 |
7 |
|
D |
27 |
5 |
1212 |
◊ |
A |
x,y,z |
1_555 |
27 |
7 |
6025 |
182.2 |
-1.2 |
0.682 |
2 |
0 |
0 |
0.080 |
8 |
|
C |
27 |
5 |
1216 |
◊ |
B |
x,y,z |
1_555 |
27 |
6 |
5722 |
170.7 |
-1.8 |
0.633 |
1 |
0 |
0 |
0.080 |
Average: |
176.4 |
-1.5 |
0.657 |
2 |
0 |
0 |
0.080 |
7 |
9 |
|
[MK8]C:27 |
8 |
1 |
317 |
◊ |
A |
x,y,z |
1_555 |
28 |
9 |
6025 |
120.1 |
-1.7 |
0.610 |
2 |
0 |
0 |
0.134 |
8 |
10 |
|
[0EH]C:20 |
11 |
1 |
383 |
cf |
C |
x,y,z |
1_555 |
18 |
5 |
1216 |
114.4 |
-1.5 |
0.787 |
2 |
0 |
0 |
0.124 |
11 |
|
[0EH]D:20 |
11 |
1 |
381 |
cf |
D |
x,y,z |
1_555 |
19 |
5 |
1212 |
113.7 |
-1.5 |
0.775 |
2 |
0 |
0 |
0.124 |
Average: |
114.1 |
-1.5 |
0.781 |
2 |
0 |
0 |
0.124 |
9 |
12 |
|
[MK8]D:27 |
8 |
1 |
316 |
◊ |
B |
x,y,z |
1_555 |
23 |
7 |
5722 |
112.8 |
-2.1 |
0.564 |
1 |
0 |
0 |
0.133 |
10 |
13 |
|
[MK8]D:27 |
8 |
1 |
316 |
cf |
D |
x,y,z |
1_555 |
14 |
4 |
1212 |
88.8 |
-1.0 |
0.883 |
2 |
0 |
0 |
0.096 |
11 |
14 |
|
[MK8]C:27 |
8 |
1 |
317 |
cf |
C |
x,y,z |
1_555 |
13 |
4 |
1216 |
86.8 |
-0.9 |
0.873 |
2 |
0 |
0 |
0.095 |
12 |
15 |
|
[ACE]D:16 |
3 |
1 |
171 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
6025 |
74.8 |
0.4 |
0.840 |
1 |
0 |
0 |
0.018 |
16 |
|
[ACE]C:16 |
3 |
1 |
171 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
5722 |
66.0 |
-0.5 |
0.693 |
1 |
0 |
0 |
0.018 |
Average: |
70.4 |
-0.0 |
0.766 |
1 |
0 |
0 |
0.018 |
13 |
17 |
|
[0EH]D:20 |
6 |
1 |
381 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
5722 |
66.7 |
-0.9 |
0.526 |
0 |
0 |
0 |
0.046 |
18 |
|
[0EH]C:20 |
7 |
1 |
383 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
6025 |
65.6 |
-0.8 |
0.546 |
0 |
0 |
0 |
0.046 |
Average: |
66.1 |
-0.9 |
0.536 |
0 |
0 |
0 |
0.046 |
14 |
19 |
|
[0EH]D:20 |
6 |
1 |
381 |
◊ |
A |
x,y,z |
1_555 |
17 |
4 |
6025 |
61.4 |
-0.8 |
0.591 |
1 |
0 |
0 |
0.046 |
20 |
|
[0EH]C:20 |
6 |
1 |
383 |
◊ |
B |
x,y,z |
1_555 |
14 |
3 |
5722 |
59.3 |
-0.8 |
0.607 |
1 |
0 |
0 |
0.046 |
Average: |
60.4 |
-0.8 |
0.599 |
1 |
0 |
0 |
0.046 |
15 |
21 |
|
[0EH]D:20 |
10 |
1 |
381 |
◊ |
[0EH]C:20 |
x,y,z |
1_555 |
10 |
1 |
383 |
56.3 |
-1.1 |
0.779 |
0 |
0 |
0 |
0.020 |
16 |
22 |
|
[ACE]C:16 |
3 |
1 |
171 |
cf |
C |
x,y,z |
1_555 |
6 |
2 |
1216 |
54.5 |
-0.1 |
0.893 |
1 |
0 |
0 |
0.030 |
23 |
|
[ACE]D:16 |
3 |
1 |
171 |
cf |
D |
x,y,z |
1_555 |
7 |
2 |
1212 |
54.2 |
-0.1 |
0.895 |
1 |
0 |
0 |
0.030 |
Average: |
54.4 |
-0.1 |
0.894 |
1 |
0 |
0 |
0.030 |
17 |
24 |
|
A |
3 |
1 |
6025 |
◊ |
B |
-x,-y+1/2,z-1/2 |
4_554 |
5 |
1 |
5722 |
48.2 |
-0.6 |
0.204 |
0 |
0 |
0 |
0.000 |
18 |
25 |
|
[MK8]C:27 |
2 |
1 |
317 |
cf |
[0EH]C:20 |
x,y,z |
1_555 |
3 |
1 |
383 |
37.4 |
-1.2 |
0.495 |
0 |
0 |
0 |
0.062 |
19 |
26 |
|
[MK8]D:27 |
1 |
1 |
316 |
cf |
[0EH]D:20 |
x,y,z |
1_555 |
3 |
1 |
381 |
36.6 |
-1.2 |
0.348 |
0 |
0 |
0 |
0.061 |
20 |
27 |
|
[NME]D:28 |
1 |
1 |
117 |
f |
D |
x,y,z |
1_555 |
6 |
4 |
1212 |
36.1 |
0.6 |
0.939 |
0 |
0 |
0 |
0.000 |
28 |
|
[NME]C:28 |
1 |
1 |
117 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
1216 |
34.4 |
0.6 |
0.933 |
0 |
0 |
0 |
0.000 |
Average: |
35.3 |
0.6 |
0.936 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[NME]D:28 |
1 |
1 |
117 |
cf |
[MK8]D:27 |
x,y,z |
1_555 |
4 |
1 |
316 |
35.6 |
0.2 |
0.912 |
0 |
0 |
0 |
0.000 |
30 |
|
[NME]C:28 |
1 |
1 |
117 |
cf |
[MK8]C:27 |
x,y,z |
1_555 |
4 |
1 |
317 |
35.1 |
0.2 |
0.912 |
0 |
0 |
0 |
0.000 |
Average: |
35.3 |
0.2 |
0.912 |
0 |
0 |
0 |
0.000 |
22 |
31 |
|
[NME]C:28 |
1 |
1 |
117 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
6025 |
34.3 |
0.6 |
0.838 |
0 |
0 |
0 |
0.000 |
32 |
|
[NME]D:28 |
1 |
1 |
117 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
5722 |
30.8 |
0.1 |
0.656 |
0 |
0 |
0 |
0.000 |
Average: |
32.6 |
0.3 |
0.747 |
0 |
0 |
0 |
0.000 |
23 |
33 |
|
B |
3 |
1 |
5722 |
◊ |
C |
x-1,y,z |
1_455 |
5 |
1 |
1216 |
33.2 |
-0.7 |
0.362 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
D |
2 |
1 |
1212 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
1216 |
30.9 |
-1.0 |
0.297 |
0 |
0 |
0 |
0.018 |
25 |
35 |
|
[MK8]D:27 |
3 |
1 |
316 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
1216 |
25.3 |
-0.8 |
0.650 |
0 |
0 |
0 |
0.015 |
26 |
36 |
|
[MK8]C:27 |
3 |
1 |
317 |
◊ |
D |
x,y,z |
1_555 |
5 |
1 |
1212 |
24.2 |
-0.8 |
0.623 |
0 |
0 |
0 |
0.014 |
27 |
37 |
|
[0EH]C:20 |
2 |
1 |
383 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
1212 |
19.9 |
-0.5 |
0.590 |
0 |
0 |
0 |
0.020 |
38 |
|
[0EH]D:20 |
2 |
1 |
381 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
1216 |
19.1 |
-0.5 |
0.606 |
0 |
0 |
0 |
0.020 |
Average: |
19.5 |
-0.5 |
0.598 |
0 |
0 |
0 |
0.020 |
28 |
39 |
|
[MK8]D:27 |
1 |
1 |
316 |
◊ |
[0EH]C:20 |
x,y,z |
1_555 |
6 |
1 |
383 |
13.3 |
-0.4 |
0.766 |
0 |
0 |
0 |
0.008 |
29 |
40 |
|
A |
6 |
3 |
6025 |
◊ |
D |
-x,y-1/2,-z+5/2 |
3_547 |
4 |
2 |
1212 |
12.9 |
-0.2 |
0.651 |
0 |
0 |
0 |
0.000 |
30 |
41 |
|
[MK8]C:27 |
1 |
1 |
317 |
◊ |
[0EH]D:20 |
x,y,z |
1_555 |
4 |
1 |
381 |
8.2 |
-0.3 |
0.735 |
0 |
0 |
0 |
0.005 |
31 |
42 |
|
[ACE]D:16 |
2 |
1 |
171 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
5722 |
7.3 |
-0.1 |
0.782 |
0 |
0 |
0 |
0.005 |
43 |
|
[ACE]C:16 |
2 |
1 |
171 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
6025 |
5.0 |
-0.1 |
0.777 |
0 |
0 |
0 |
0.005 |
Average: |
6.2 |
-0.1 |
0.780 |
0 |
0 |
0 |
0.005 |
|