## |
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 |
|
B |
82 |
23 |
8246 |
◊ |
A |
x,y,z |
1_555 |
85 |
22 |
8239 |
782.5 |
6.2 |
0.872 |
13 |
13 |
0 |
0.000 |
2 |
2 |
|
B |
73 |
16 |
8246 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
76 |
19 |
8239 |
638.3 |
2.4 |
0.719 |
14 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
36 |
11 |
8239 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
32 |
10 |
8239 |
326.3 |
-2.2 |
0.280 |
4 |
0 |
0 |
0.000 |
4 |
4 |
|
B |
37 |
13 |
8246 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
32 |
9 |
8239 |
312.5 |
-0.7 |
0.453 |
4 |
0 |
0 |
0.000 |
5 |
5 |
|
B |
27 |
9 |
8246 |
x |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
26 |
7 |
8246 |
263.5 |
-0.1 |
0.532 |
6 |
0 |
0 |
0.000 |
6 |
6 |
|
A |
23 |
8 |
8239 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
30 |
9 |
8246 |
228.1 |
-3.8 |
0.140 |
1 |
0 |
0 |
0.000 |
7 |
7 |
|
A |
19 |
5 |
8239 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
19 |
5 |
8246 |
173.3 |
-2.4 |
0.234 |
5 |
0 |
0 |
0.000 |
8 |
8 |
|
[IOD]B:168 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
8246 |
95.4 |
-0.7 |
0.536 |
0 |
0 |
0 |
0.029 |
9 |
9 |
|
[IOD]A:163 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
8239 |
89.7 |
0.8 |
0.849 |
0 |
0 |
0 |
0.000 |
10 |
|
[IOD]B:161 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
8246 |
78.6 |
0.2 |
0.751 |
0 |
0 |
0 |
0.000 |
Average: |
84.2 |
0.5 |
0.800 |
0 |
0 |
0 |
0.000 |
10 |
11 |
|
[IOD]B:160 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
17 |
10 |
8246 |
89.1 |
-0.1 |
0.674 |
0 |
0 |
0 |
0.011 |
12 |
|
[IOD]A:167 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
8239 |
87.2 |
-0.1 |
0.679 |
0 |
0 |
0 |
0.011 |
Average: |
88.2 |
-0.1 |
0.676 |
0 |
0 |
0 |
0.011 |
11 |
13 |
|
[IOD]A:158 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
8239 |
84.7 |
0.4 |
0.790 |
0 |
0 |
0 |
0.020 |
14 |
|
[IOD]B:158 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
8246 |
81.9 |
-0.5 |
0.601 |
0 |
0 |
0 |
0.020 |
Average: |
83.3 |
-0.0 |
0.696 |
0 |
0 |
0 |
0.020 |
12 |
15 |
|
[IOD]A:156 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
8239 |
83.4 |
0.1 |
0.717 |
0 |
0 |
0 |
0.000 |
16 |
|
[IOD]B:157 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
8246 |
79.1 |
0.1 |
0.732 |
0 |
0 |
0 |
0.000 |
Average: |
81.3 |
0.1 |
0.724 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
[IOD]A:162 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
8239 |
78.0 |
-0.4 |
0.616 |
0 |
0 |
0 |
0.032 |
14 |
18 |
|
[IOD]A:161 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
8239 |
71.6 |
-0.1 |
0.690 |
0 |
0 |
0 |
0.017 |
19 |
|
[IOD]B:162 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
8246 |
70.5 |
-0.4 |
0.592 |
0 |
0 |
0 |
0.017 |
Average: |
71.0 |
-0.2 |
0.641 |
0 |
0 |
0 |
0.017 |
15 |
20 |
|
[IOD]B:169 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
8246 |
69.8 |
-0.4 |
0.594 |
0 |
0 |
0 |
0.000 |
21 |
|
A |
10 |
5 |
8239 |
◊ |
[IOD]B:165 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
144 |
58.4 |
-0.5 |
0.566 |
0 |
0 |
0 |
0.000 |
Average: |
64.1 |
-0.4 |
0.580 |
0 |
0 |
0 |
0.000 |
16 |
22 |
|
[IOD]A:160 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
8239 |
68.0 |
-0.3 |
0.625 |
0 |
0 |
0 |
0.024 |
23 |
|
[IOD]B:164 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
8246 |
66.1 |
-0.3 |
0.629 |
0 |
0 |
0 |
0.024 |
Average: |
67.1 |
-0.3 |
0.627 |
0 |
0 |
0 |
0.024 |
17 |
24 |
|
[IOD]B:167 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
8246 |
65.8 |
0.7 |
0.859 |
0 |
0 |
0 |
0.006 |
25 |
|
[IOD]A:166 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
8239 |
62.6 |
-0.1 |
0.698 |
0 |
0 |
0 |
0.006 |
Average: |
64.2 |
0.3 |
0.778 |
0 |
0 |
0 |
0.006 |
18 |
26 |
|
[IOD]A:157 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
8239 |
64.0 |
-0.4 |
0.597 |
0 |
0 |
0 |
0.035 |
27 |
|
[IOD]B:163 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
8246 |
61.6 |
-0.4 |
0.619 |
0 |
0 |
0 |
0.035 |
Average: |
62.8 |
-0.4 |
0.608 |
0 |
0 |
0 |
0.035 |
19 |
28 |
|
[IOD]B:155 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
8246 |
61.4 |
0.3 |
0.798 |
0 |
0 |
0 |
0.014 |
29 |
|
[IOD]A:155 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
8239 |
57.1 |
-0.2 |
0.672 |
0 |
0 |
0 |
0.014 |
Average: |
59.2 |
0.1 |
0.735 |
0 |
0 |
0 |
0.014 |
20 |
30 |
|
[IOD]B:170 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
8246 |
60.8 |
0.4 |
0.815 |
0 |
0 |
0 |
0.000 |
21 |
31 |
|
[IOD]B:156 |
1 |
1 |
144 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
10 |
4 |
8239 |
60.6 |
-0.1 |
0.698 |
0 |
0 |
0 |
0.000 |
22 |
32 |
|
[IOD]A:164 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
8239 |
60.0 |
-0.3 |
0.623 |
0 |
0 |
0 |
0.020 |
23 |
33 |
|
[IOD]B:156 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
8246 |
59.9 |
-0.2 |
0.695 |
0 |
0 |
0 |
0.007 |
24 |
34 |
|
[IOD]A:155 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
8246 |
59.9 |
0.6 |
0.857 |
0 |
0 |
0 |
0.000 |
35 |
|
[IOD]B:155 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
8239 |
58.1 |
0.4 |
0.808 |
0 |
0 |
0 |
0.000 |
Average: |
59.0 |
0.5 |
0.832 |
0 |
0 |
0 |
0.000 |
25 |
36 |
|
[IOD]B:165 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
8246 |
56.3 |
-0.9 |
0.323 |
0 |
0 |
0 |
0.041 |
26 |
37 |
|
[IOD]B:166 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
8246 |
52.3 |
-0.5 |
0.564 |
0 |
0 |
0 |
0.000 |
38 |
|
[IOD]B:159 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
8246 |
51.7 |
-0.3 |
0.560 |
0 |
0 |
0 |
0.000 |
39 |
|
[IOD]A:159 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
8239 |
47.9 |
0.2 |
0.834 |
0 |
0 |
0 |
0.000 |
40 |
|
[IOD]B:166 |
1 |
1 |
144 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
5 |
3 |
8239 |
25.6 |
0.3 |
0.904 |
0 |
0 |
0 |
0.000 |
Average: |
44.4 |
-0.0 |
0.715 |
0 |
0 |
0 |
0.000 |
27 |
41 |
|
[IOD]A:165 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
8239 |
51.8 |
0.0 |
0.737 |
0 |
0 |
0 |
0.000 |
28 |
42 |
|
[IOD]B:159 |
1 |
1 |
144 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
10 |
3 |
8239 |
43.6 |
0.1 |
0.786 |
0 |
0 |
0 |
0.000 |
43 |
|
B |
11 |
3 |
8246 |
◊ |
[IOD]A:159 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
144 |
41.1 |
-0.0 |
0.737 |
0 |
0 |
0 |
0.000 |
Average: |
42.3 |
0.0 |
0.762 |
0 |
0 |
0 |
0.000 |
29 |
44 |
|
A |
5 |
3 |
8239 |
f |
[IOD]B:170 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
144 |
33.8 |
-0.3 |
0.593 |
0 |
0 |
0 |
0.023 |
30 |
45 |
|
[IOD]B:166 |
1 |
1 |
144 |
◊ |
[IOD]A:159 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
144 |
32.8 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
31 |
46 |
|
[IOD]B:158 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
8239 |
31.0 |
0.4 |
0.910 |
0 |
0 |
0 |
0.000 |
47 |
|
[IOD]A:158 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
8246 |
28.4 |
0.7 |
0.911 |
0 |
0 |
0 |
0.000 |
Average: |
29.7 |
0.6 |
0.911 |
0 |
0 |
0 |
0.000 |
32 |
48 |
|
[IOD]A:165 |
1 |
1 |
144 |
f |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
1 |
8239 |
30.7 |
-0.4 |
0.493 |
0 |
0 |
0 |
0.033 |
33 |
49 |
|
[IOD]B:168 |
1 |
1 |
144 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
2 |
1 |
8239 |
26.2 |
0.8 |
0.973 |
0 |
0 |
0 |
0.000 |
34 |
50 |
|
[IOD]A:165 |
1 |
1 |
144 |
◊ |
[IOD]A:164 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
144 |
23.7 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
35 |
51 |
|
[IOD]B:169 |
1 |
1 |
144 |
◊ |
[IOD]B:162 |
x,y,z |
1_555 |
1 |
1 |
144 |
20.7 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
36 |
52 |
|
[IOD]B:166 |
1 |
1 |
144 |
f |
[IOD]B:159 |
x,y,z |
1_555 |
1 |
1 |
144 |
17.4 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
37 |
53 |
|
[IOD]B:164 |
1 |
1 |
144 |
◊ |
[IOD]A:160 |
x,y,z |
1_555 |
1 |
1 |
144 |
10.1 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
38 |
54 |
|
[IOD]A:160 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
8246 |
10.0 |
-0.1 |
0.471 |
0 |
0 |
0 |
0.000 |
55 |
|
[IOD]B:164 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
8239 |
8.9 |
-0.1 |
0.479 |
0 |
0 |
0 |
0.000 |
Average: |
9.5 |
-0.1 |
0.475 |
0 |
0 |
0 |
0.000 |
39 |
56 |
|
A |
2 |
1 |
8239 |
f |
[IOD]A:159 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
144 |
9.1 |
-0.1 |
0.583 |
0 |
0 |
0 |
0.013 |
57 |
|
[IOD]B:159 |
1 |
1 |
144 |
f |
B |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
8246 |
7.9 |
-0.1 |
0.615 |
0 |
0 |
0 |
0.013 |
Average: |
8.5 |
-0.1 |
0.599 |
0 |
0 |
0 |
0.013 |
40 |
58 |
|
[IOD]B:166 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
8239 |
7.0 |
-0.1 |
0.610 |
0 |
0 |
0 |
0.000 |
41 |
59 |
|
[IOD]A:161 |
1 |
1 |
144 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
8246 |
5.0 |
0.1 |
0.869 |
0 |
0 |
0 |
0.000 |
42 |
60 |
|
[IOD]B:157 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
8239 |
4.1 |
-0.1 |
0.606 |
0 |
0 |
0 |
0.005 |
61 |
|
[IOD]A:156 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
8246 |
2.3 |
-0.0 |
0.645 |
0 |
0 |
0 |
0.005 |
Average: |
3.2 |
-0.0 |
0.625 |
0 |
0 |
0 |
0.005 |
43 |
62 |
|
[IOD]B:159 |
1 |
1 |
144 |
◊ |
[IOD]A:159 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
144 |
2.8 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
44 |
63 |
|
B |
1 |
1 |
8246 |
◊ |
[IOD]A:155 |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
144 |
1.4 |
-0.0 |
0.687 |
0 |
0 |
0 |
0.000 |
45 |
64 |
|
B |
1 |
1 |
8246 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
8246 |
1.0 |
-0.0 |
0.587 |
0 |
0 |
0 |
0.000 |
|