| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
49A |
529 |
119 |
30820 |
◊ |
A |
x,y,z |
1_555 |
555 |
130 |
30820 |
5228.0 |
-56.4 |
0.086 |
75 |
19 |
0 |
0.000 |
2 |
|
36A |
233 |
66 |
30820 |
◊ |
A |
x,y,z |
1_555 |
238 |
63 |
30820 |
2160.1 |
-18.3 |
0.420 |
32 |
5 |
0 |
0.000 |
3 |
|
43A |
204 |
57 |
30820 |
◊ |
A |
x,y,z |
1_555 |
207 |
57 |
30820 |
1940.6 |
-22.0 |
0.195 |
33 |
0 |
0 |
0.000 |
4 |
|
C |
76 |
8 |
2407 |
◊ |
A |
x,y,z |
1_555 |
78 |
24 |
30820 |
661.8 |
-3.5 |
0.616 |
9 |
0 |
0 |
0.000 |
5 |
|
49A |
48 |
15 |
30820 |
◊ |
60A |
-x,y-1/2,-z |
2_545 |
45 |
12 |
30820 |
469.3 |
-1.1 |
0.714 |
6 |
0 |
0 |
0.000 |
6 |
|
24A |
45 |
14 |
30820 |
◊ |
11A |
-x+1,y-1/2,-z |
2_645 |
41 |
13 |
30820 |
408.9 |
-1.4 |
0.583 |
5 |
1 |
0 |
0.000 |
7 |
|
21A |
40 |
12 |
30820 |
◊ |
3A |
-x+1,y-1/2,-z+1 |
2_646 |
48 |
13 |
30820 |
401.3 |
-0.4 |
0.766 |
8 |
0 |
0 |
0.000 |
8 |
|
20A |
33 |
10 |
30820 |
◊ |
5A |
-x+1,y-1/2,-z+1 |
2_646 |
31 |
13 |
30820 |
310.4 |
-1.4 |
0.586 |
2 |
2 |
0 |
0.000 |
9 |
|
51C |
33 |
5 |
2407 |
◊ |
A |
x,y,z |
1_555 |
37 |
14 |
30820 |
299.0 |
-0.1 |
0.594 |
2 |
0 |
0 |
0.000 |
10 |
|
33A |
31 |
13 |
30820 |
◊ |
57A |
-x,y-1/2,-z |
2_545 |
29 |
9 |
30820 |
267.0 |
-3.2 |
0.378 |
0 |
0 |
0 |
0.000 |
11 |
|
38A |
27 |
11 |
30820 |
◊ |
29A |
-x,y-1/2,-z+1 |
2_546 |
30 |
12 |
30820 |
232.7 |
-0.8 |
0.648 |
0 |
3 |
0 |
0.000 |
12 |
|
48A |
29 |
9 |
30820 |
◊ |
11A |
-x,y-1/2,-z |
2_545 |
23 |
7 |
30820 |
220.3 |
-1.5 |
0.571 |
2 |
1 |
0 |
0.000 |
13 |
|
19A |
30 |
10 |
30820 |
◊ |
3A |
-x+1,y-1/2,-z+1 |
2_646 |
24 |
8 |
30820 |
220.0 |
-0.6 |
0.634 |
3 |
0 |
0 |
0.000 |
14 |
|
30A |
24 |
12 |
30820 |
◊ |
29A |
-x,y-1/2,-z+1 |
2_546 |
26 |
9 |
30820 |
198.2 |
-1.7 |
0.533 |
0 |
0 |
0 |
0.000 |
15 |
|
52A |
21 |
7 |
30820 |
◊ |
59A |
-x,y-1/2,-z |
2_545 |
25 |
8 |
30820 |
194.8 |
-0.9 |
0.522 |
3 |
0 |
0 |
0.000 |
16 |
|
44C |
21 |
4 |
2407 |
◊ |
A |
x,y,z |
1_555 |
21 |
6 |
30820 |
185.4 |
-3.4 |
0.336 |
3 |
0 |
0 |
0.000 |
17 |
|
40A |
21 |
5 |
30820 |
◊ |
41A |
-x,y-1/2,-z+1 |
2_546 |
19 |
6 |
30820 |
177.7 |
-0.1 |
0.677 |
1 |
0 |
0 |
0.000 |
18 |
|
38A |
17 |
6 |
30820 |
◊ |
42A |
-x,y-1/2,-z+1 |
2_546 |
25 |
9 |
30820 |
172.1 |
-0.9 |
0.504 |
1 |
0 |
0 |
0.000 |
19 |
|
33A |
15 |
7 |
30820 |
◊ |
59A |
-x,y-1/2,-z |
2_545 |
18 |
8 |
30820 |
163.3 |
1.7 |
0.841 |
1 |
0 |
0 |
0.000 |
20 |
|
30A |
16 |
5 |
30820 |
◊ |
50A |
-x+1,y-1/2,-z+1 |
2_646 |
17 |
7 |
30820 |
162.9 |
-3.1 |
0.193 |
0 |
0 |
0 |
0.000 |
21 |
|
31A |
16 |
7 |
30820 |
◊ |
27A |
-x+1,y-1/2,-z |
2_645 |
25 |
7 |
30820 |
161.3 |
-0.1 |
0.714 |
0 |
0 |
0 |
0.000 |
22 |
|
56A |
19 |
5 |
30820 |
◊ |
16A |
x,y,z-1 |
1_554 |
18 |
7 |
30820 |
145.5 |
-0.9 |
0.574 |
0 |
0 |
0 |
0.000 |
23 |
|
18A |
19 |
8 |
30820 |
◊ |
3A |
-x+1,y-1/2,-z+1 |
2_646 |
18 |
7 |
30820 |
144.9 |
-0.1 |
0.694 |
2 |
0 |
0 |
0.000 |
24 |
|
34A |
15 |
4 |
30820 |
◊ |
25A |
-x+1,y-1/2,-z |
2_645 |
16 |
7 |
30820 |
140.9 |
-1.6 |
0.408 |
1 |
0 |
0 |
0.000 |
25 |
|
44A |
15 |
5 |
30820 |
◊ |
13A |
-x,y-1/2,-z+1 |
2_546 |
15 |
5 |
30820 |
136.7 |
-0.7 |
0.574 |
1 |
0 |
0 |
0.000 |
26 |
|
52A |
15 |
4 |
30820 |
◊ |
15A |
x,y,z-1 |
1_554 |
16 |
6 |
30820 |
132.3 |
-1.2 |
0.489 |
0 |
0 |
0 |
0.000 |
27 |
|
43A |
13 |
5 |
30820 |
◊ |
6A |
x-1,y,z |
1_455 |
10 |
5 |
30820 |
127.2 |
0.5 |
0.687 |
1 |
0 |
0 |
0.000 |
28 |
|
A |
9 |
5 |
30820 |
◊ |
13A |
-x,y-1/2,-z+1 |
2_546 |
22 |
9 |
30820 |
122.6 |
0.0 |
0.715 |
1 |
0 |
0 |
0.000 |
29 |
|
19A |
13 |
6 |
30820 |
◊ |
13A |
-x+1,y-1/2,-z+1 |
2_646 |
14 |
7 |
30820 |
118.3 |
1.1 |
0.801 |
0 |
0 |
0 |
0.000 |
30 |
|
37A |
11 |
6 |
30820 |
◊ |
57A |
-x,y-1/2,-z |
2_545 |
16 |
6 |
30820 |
117.7 |
-1.8 |
0.347 |
0 |
0 |
0 |
0.000 |
31 |
|
32A |
15 |
3 |
30820 |
◊ |
7A |
-x+1,y-1/2,-z |
2_645 |
16 |
7 |
30820 |
114.7 |
-0.4 |
0.638 |
2 |
0 |
0 |
0.000 |
32 |
|
24A |
9 |
4 |
30820 |
◊ |
27A |
-x+1,y-1/2,-z |
2_645 |
14 |
7 |
30820 |
111.9 |
-0.7 |
0.513 |
1 |
0 |
0 |
0.000 |
33 |
|
21A |
14 |
6 |
30820 |
◊ |
4A |
-x+1,y-1/2,-z+1 |
2_646 |
14 |
6 |
30820 |
109.6 |
1.0 |
0.834 |
0 |
0 |
0 |
0.000 |
34 |
|
34A |
10 |
4 |
30820 |
◊ |
57A |
-x,y-1/2,-z |
2_545 |
10 |
3 |
30820 |
108.5 |
-0.4 |
0.464 |
0 |
0 |
0 |
0.000 |
35 |
|
21A |
9 |
4 |
30820 |
◊ |
13A |
-x+1,y-1/2,-z+1 |
2_646 |
10 |
4 |
30820 |
96.9 |
0.9 |
0.751 |
1 |
0 |
0 |
0.000 |
36 |
|
19A |
9 |
4 |
30820 |
◊ |
50A |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
4 |
30820 |
96.7 |
-1.1 |
0.406 |
1 |
0 |
0 |
0.000 |
37 |
|
43A |
9 |
4 |
30820 |
◊ |
7A |
x-1,y,z |
1_455 |
12 |
6 |
30820 |
95.3 |
-0.6 |
0.455 |
1 |
0 |
0 |
0.000 |
38 |
|
32A |
10 |
4 |
30820 |
◊ |
9A |
-x+1,y-1/2,-z |
2_645 |
14 |
6 |
30820 |
90.4 |
0.0 |
0.668 |
1 |
0 |
0 |
0.000 |
39 |
|
33A |
10 |
5 |
30820 |
◊ |
58A |
-x,y-1/2,-z |
2_545 |
14 |
5 |
30820 |
89.6 |
0.9 |
0.831 |
0 |
0 |
0 |
0.000 |
40 |
|
30A |
8 |
3 |
30820 |
◊ |
9A |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
3 |
30820 |
89.4 |
0.5 |
0.777 |
2 |
1 |
0 |
0.000 |
41 |
|
34A |
11 |
4 |
30820 |
◊ |
59A |
-x,y-1/2,-z |
2_545 |
8 |
3 |
30820 |
86.7 |
-0.2 |
0.631 |
0 |
0 |
0 |
0.000 |
42 |
|
38A |
10 |
4 |
30820 |
◊ |
41A |
-x,y-1/2,-z+1 |
2_546 |
8 |
3 |
30820 |
79.0 |
0.8 |
0.815 |
2 |
0 |
0 |
0.000 |
43 |
|
[NA]A:605 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
30820 |
77.2 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.000 |
44 |
|
19A |
10 |
6 |
30820 |
◊ |
4A |
-x+1,y-1/2,-z+1 |
2_646 |
10 |
4 |
30820 |
76.3 |
0.2 |
0.724 |
0 |
0 |
0 |
0.000 |
45 |
|
32A |
8 |
4 |
30820 |
◊ |
27A |
-x+1,y-1/2,-z |
2_645 |
10 |
3 |
30820 |
75.8 |
-1.5 |
0.311 |
0 |
0 |
0 |
0.000 |
46 |
|
44A |
6 |
3 |
30820 |
◊ |
28A |
-x,y-1/2,-z+1 |
2_546 |
11 |
4 |
30820 |
69.0 |
-0.7 |
0.406 |
0 |
0 |
0 |
0.000 |
47 |
|
55A |
13 |
5 |
30820 |
◊ |
14A |
x,y,z-1 |
1_554 |
11 |
4 |
30820 |
64.7 |
-0.2 |
0.636 |
0 |
0 |
0 |
0.000 |
48 |
|
54A |
9 |
2 |
30820 |
◊ |
15A |
x,y,z-1 |
1_554 |
8 |
3 |
30820 |
61.7 |
0.1 |
0.668 |
0 |
0 |
0 |
0.000 |
49 |
|
[NA]A:607 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
8 |
7 |
30820 |
60.9 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.000 |
50 |
|
[CL]A:608 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
30820 |
55.0 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.000 |
51 |
|
[MG]C:101 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
2407 |
54.8 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.000 |
52 |
|
31A |
3 |
1 |
30820 |
◊ |
11A |
-x+1,y-1/2,-z |
2_645 |
10 |
4 |
30820 |
52.9 |
0.2 |
0.581 |
0 |
0 |
0 |
0.000 |
53 |
|
51[CL]A:608 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
30820 |
50.8 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.000 |
54 |
|
54A |
5 |
3 |
30820 |
◊ |
39A |
x,y,z-1 |
1_554 |
5 |
1 |
30820 |
44.0 |
-1.0 |
0.272 |
0 |
0 |
0 |
0.000 |
55 |
|
36A |
6 |
2 |
30820 |
◊ |
28A |
-x,y-1/2,-z+1 |
2_546 |
2 |
2 |
30820 |
44.0 |
-1.2 |
0.126 |
0 |
0 |
0 |
0.000 |
56 |
|
[MG]C:102 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
2407 |
42.2 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.000 |
57 |
|
42A |
6 |
3 |
30820 |
◊ |
7A |
x-1,y,z |
1_455 |
3 |
2 |
30820 |
36.4 |
-0.6 |
0.353 |
0 |
0 |
0 |
0.000 |
58 |
|
32A |
4 |
2 |
30820 |
◊ |
10A |
-x+1,y-1/2,-z |
2_645 |
5 |
2 |
30820 |
35.8 |
0.7 |
0.569 |
0 |
0 |
0 |
0.000 |
59 |
|
35A |
3 |
2 |
30820 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
30820 |
35.7 |
0.1 |
0.601 |
0 |
0 |
0 |
0.000 |
60 |
|
30A |
3 |
2 |
30820 |
◊ |
42A |
-x,y-1/2,-z+1 |
2_546 |
3 |
3 |
30820 |
33.6 |
0.4 |
0.749 |
1 |
0 |
0 |
0.000 |
61 |
|
49[NA]A:605 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
30820 |
33.0 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
62 |
|
26A |
8 |
3 |
30820 |
◊ |
16A |
x,y,z-1 |
1_554 |
4 |
1 |
30820 |
32.7 |
0.1 |
0.685 |
0 |
0 |
0 |
0.000 |
63 |
|
53A |
5 |
3 |
30820 |
◊ |
59A |
-x,y-1/2,-z |
2_545 |
4 |
2 |
30820 |
31.6 |
-0.2 |
0.503 |
0 |
0 |
0 |
0.000 |
64 |
|
49[NA]A:607 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
30820 |
30.4 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.000 |
65 |
|
31A |
2 |
2 |
30820 |
◊ |
10A |
-x+1,y-1/2,-z |
2_645 |
3 |
2 |
30820 |
30.0 |
-0.2 |
0.334 |
0 |
0 |
0 |
0.000 |
66 |
|
19A |
5 |
1 |
30820 |
◊ |
2A |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
2 |
30820 |
29.9 |
0.2 |
0.692 |
0 |
0 |
0 |
0.000 |
67 |
|
51A |
5 |
3 |
30820 |
◊ |
7A |
x-1,y,z |
1_455 |
5 |
3 |
30820 |
26.7 |
-0.8 |
0.343 |
0 |
0 |
0 |
0.000 |
68 |
|
47A |
5 |
4 |
30820 |
◊ |
11A |
-x,y-1/2,-z |
2_545 |
4 |
2 |
30820 |
25.2 |
0.2 |
0.709 |
0 |
0 |
0 |
0.000 |
69 |
|
[MG]C:102 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
30820 |
22.8 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.000 |
70 |
|
32A |
2 |
1 |
30820 |
◊ |
8A |
-x+1,y-1/2,-z |
2_645 |
3 |
1 |
30820 |
21.6 |
0.4 |
0.797 |
0 |
0 |
0 |
0.000 |
71 |
|
[MG]C:101 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
30820 |
20.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
72 |
|
53A |
3 |
2 |
30820 |
◊ |
58A |
-x,y-1/2,-z |
2_545 |
2 |
2 |
30820 |
17.7 |
0.4 |
0.813 |
0 |
0 |
0 |
0.000 |
73 |
|
48A |
2 |
1 |
30820 |
◊ |
60A |
-x,y-1/2,-z |
2_545 |
2 |
1 |
30820 |
16.9 |
-0.3 |
0.360 |
0 |
0 |
0 |
0.000 |
74 |
|
52A |
2 |
1 |
30820 |
◊ |
58A |
-x,y-1/2,-z |
2_545 |
2 |
1 |
30820 |
15.3 |
-0.5 |
0.268 |
0 |
0 |
0 |
0.000 |
75 |
|
40A |
2 |
1 |
30820 |
◊ |
29A |
-x,y-1/2,-z+1 |
2_546 |
4 |
2 |
30820 |
14.8 |
-0.3 |
0.413 |
0 |
0 |
0 |
0.000 |
76 |
|
24A |
3 |
2 |
30820 |
◊ |
10A |
-x+1,y-1/2,-z |
2_645 |
4 |
3 |
30820 |
12.9 |
-0.2 |
0.502 |
0 |
0 |
0 |
0.000 |
77 |
|
A |
2 |
2 |
30820 |
◊ |
22A |
x-1,y,z |
1_455 |
4 |
2 |
30820 |
12.1 |
-0.2 |
0.428 |
0 |
0 |
0 |
0.000 |
78 |
|
48A |
3 |
2 |
30820 |
◊ |
59A |
-x,y-1/2,-z |
2_545 |
1 |
1 |
30820 |
10.8 |
-0.1 |
0.376 |
0 |
0 |
0 |
0.000 |
79 |
|
36A |
1 |
1 |
30820 |
◊ |
29A |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
30820 |
10.5 |
0.2 |
0.442 |
0 |
0 |
0 |
0.000 |
80 |
|
44A |
1 |
1 |
30820 |
◊ |
29A |
-x,y-1/2,-z+1 |
2_546 |
3 |
2 |
30820 |
9.6 |
-0.3 |
0.323 |
0 |
0 |
0 |
0.000 |
81 |
|
A |
2 |
1 |
30820 |
◊ |
28A |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
30820 |
8.2 |
0.1 |
0.706 |
0 |
0 |
0 |
0.000 |
82 |
|
19A |
1 |
1 |
30820 |
◊ |
12A |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
30820 |
7.9 |
-0.3 |
0.253 |
0 |
0 |
0 |
0.000 |
83 |
|
51A |
1 |
1 |
30820 |
◊ |
22A |
x-1,y,z |
1_455 |
1 |
1 |
30820 |
6.9 |
0.2 |
0.838 |
0 |
0 |
0 |
0.000 |
84 |
|
32A |
1 |
1 |
30820 |
◊ |
26A |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
30820 |
5.8 |
-0.2 |
0.306 |
0 |
0 |
0 |
0.000 |
85 |
|
33A |
3 |
1 |
30820 |
◊ |
7A |
-x+1,y-1/2,-z |
2_645 |
2 |
2 |
30820 |
4.5 |
-0.1 |
0.561 |
0 |
0 |
0 |
0.000 |
86 |
|
33A |
1 |
1 |
30820 |
◊ |
8A |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
30820 |
4.1 |
0.1 |
0.756 |
0 |
0 |
0 |
0.000 |
87 |
|
22A |
2 |
1 |
30820 |
◊ |
27A |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
30820 |
4.0 |
0.0 |
0.679 |
0 |
0 |
0 |
0.000 |
88 |
|
49A |
1 |
1 |
30820 |
◊ |
57A |
-x,y-1/2,-z |
2_545 |
1 |
1 |
30820 |
3.4 |
-0.0 |
0.541 |
0 |
0 |
0 |
0.000 |
89 |
|
20A |
1 |
1 |
30820 |
◊ |
50A |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
30820 |
3.4 |
0.1 |
0.774 |
0 |
0 |
0 |
0.000 |
90 |
|
49A |
1 |
1 |
30820 |
◊ |
27A |
-x,y-1/2,-z |
2_545 |
1 |
1 |
30820 |
3.2 |
-0.0 |
0.542 |
0 |
0 |
0 |
0.000 |
91 |
|
52A |
1 |
1 |
30820 |
◊ |
40A |
x,y,z-1 |
1_554 |
1 |
1 |
30820 |
2.6 |
-0.1 |
0.428 |
0 |
0 |
0 |
0.000 |
92 |
|
58A |
1 |
1 |
30820 |
◊ |
7A |
x-1,y,z |
1_455 |
1 |
1 |
30820 |
2.4 |
0.1 |
0.721 |
0 |
0 |
0 |
0.000 |
93 |
|
30A |
1 |
1 |
30820 |
◊ |
41A |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
30820 |
2.3 |
-0.1 |
0.445 |
0 |
0 |
0 |
0.000 |
94 |
|
34A |
1 |
1 |
30820 |
◊ |
8A |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
30820 |
1.9 |
0.1 |
0.720 |
0 |
0 |
0 |
0.000 |
95 |
|
55A |
1 |
1 |
30820 |
◊ |
4A |
x,y,z-1 |
1_554 |
1 |
1 |
30820 |
1.7 |
0.0 |
0.713 |
0 |
0 |
0 |
0.000 |
96 |
|
44A |
2 |
2 |
30820 |
◊ |
3A |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
30820 |
1.4 |
-0.0 |
0.616 |
0 |
0 |
0 |
0.000 |
97 |
|
18A |
1 |
1 |
30820 |
◊ |
13A |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
30820 |
1.1 |
-0.0 |
0.595 |
0 |
0 |
0 |
0.000 |
|