## |
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 |
|
A |
79 |
23 |
10075 |
x |
A |
-y+1,x-y+1,z |
2_665 |
65 |
21 |
10075 |
637.3 |
-13.8 |
0.314 |
1 |
1 |
0 |
0.188 |
2 |
|
A |
48 |
16 |
10075 |
f |
[LI1]A:607 |
-y+1,x-y+1,z |
2_665 |
33 |
1 |
1051 |
369.0 |
-7.3 |
0.534 |
0 |
0 |
0 |
0.100 |
3 |
|
[RET]A:301 |
19 |
1 |
543 |
cf |
A |
x,y,z |
1_555 |
63 |
18 |
10075 |
361.6 |
-1.0 |
0.688 |
0 |
0 |
0 |
0.014 |
4 |
|
[SQU]A:701 |
24 |
1 |
707 |
◊ |
A |
x,y,z |
1_555 |
39 |
13 |
10075 |
315.6 |
-2.1 |
0.410 |
0 |
0 |
0 |
0.028 |
5 |
|
[LI1]A:610 |
31 |
1 |
894 |
f |
A |
x,y,z |
1_555 |
34 |
12 |
10075 |
301.0 |
-4.2 |
0.701 |
1 |
0 |
0 |
0.063 |
6 |
|
[LI1]A:602 |
30 |
1 |
878 |
f |
A |
x,y,z |
1_555 |
30 |
9 |
10075 |
288.9 |
-6.5 |
0.515 |
0 |
0 |
0 |
0.089 |
7 |
|
[LI1]A:612 |
16 |
1 |
567 |
f |
A |
x,y,z |
1_555 |
42 |
14 |
10075 |
273.9 |
-7.7 |
0.560 |
0 |
0 |
0 |
0.106 |
8 |
|
[LI1]A:607 |
20 |
1 |
1051 |
◊ |
A |
x,y,z |
1_555 |
34 |
9 |
10075 |
243.2 |
-5.6 |
0.567 |
0 |
0 |
0 |
0.073 |
9 |
|
A |
21 |
9 |
10075 |
◊ |
[LI1]A:602 |
-y+2,x-y+1,z |
2_765 |
20 |
1 |
878 |
221.1 |
-4.4 |
0.396 |
0 |
0 |
0 |
0.061 |
10 |
|
[LI1]A:613 |
13 |
1 |
436 |
◊ |
A |
x,y,z |
1_555 |
27 |
9 |
10075 |
212.4 |
-1.8 |
0.397 |
0 |
0 |
0 |
0.023 |
11 |
|
[LI1]A:611 |
16 |
1 |
534 |
f |
A |
x,y,z |
1_555 |
25 |
6 |
10075 |
187.0 |
-4.1 |
0.498 |
0 |
0 |
0 |
0.056 |
12 |
|
A |
21 |
9 |
10075 |
◊ |
[LI1]A:609 |
-y+2,x-y+1,z |
2_765 |
12 |
1 |
540 |
176.9 |
-3.5 |
0.584 |
0 |
0 |
0 |
0.048 |
13 |
|
A |
27 |
9 |
10075 |
◊ |
[LI1]A:612 |
-y+1,x-y+1,z |
2_665 |
15 |
1 |
567 |
172.9 |
-2.0 |
0.811 |
0 |
0 |
0 |
0.026 |
14 |
|
[LI1]A:603 |
15 |
1 |
572 |
f |
A |
x,y,z |
1_555 |
21 |
12 |
10075 |
171.2 |
-4.7 |
0.465 |
0 |
0 |
0 |
0.064 |
15 |
|
[LI1]A:601 |
13 |
1 |
742 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
10075 |
144.4 |
-2.5 |
0.475 |
0 |
0 |
0 |
0.034 |
16 |
|
A |
18 |
6 |
10075 |
x |
A |
x-y+1,x,z+1/2 |
6_655 |
21 |
7 |
10075 |
144.4 |
-1.2 |
0.833 |
0 |
0 |
0 |
0.000 |
17 |
|
[SQU]A:701 |
17 |
1 |
707 |
◊ |
[LI1]A:608 |
-y+2,x-y+1,z |
2_765 |
16 |
1 |
568 |
140.9 |
-0.7 |
0.482 |
0 |
0 |
0 |
0.009 |
18 |
|
[LI1]A:601 |
14 |
1 |
742 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
12 |
7 |
10075 |
124.2 |
-1.6 |
0.364 |
0 |
0 |
0 |
0.021 |
19 |
|
[LI1]A:606 |
8 |
1 |
319 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
10075 |
121.9 |
-2.7 |
0.655 |
0 |
0 |
0 |
0.037 |
20 |
|
[LI1]A:610 |
15 |
1 |
894 |
◊ |
[LI1]A:609 |
-y+2,x-y+1,z |
2_765 |
14 |
1 |
540 |
121.6 |
-1.5 |
0.830 |
0 |
0 |
0 |
0.020 |
21 |
|
[LI1]A:604 |
11 |
1 |
527 |
◊ |
[LI1]A:603 |
-y+2,x-y+1,z |
2_765 |
11 |
1 |
572 |
121.4 |
-1.9 |
0.875 |
0 |
0 |
0 |
0.023 |
22 |
|
[LI1]A:604 |
12 |
1 |
527 |
fx |
[LI1]A:604 |
-y+2,x-y+1,z |
2_765 |
12 |
1 |
527 |
112.5 |
-2.1 |
0.849 |
0 |
0 |
0 |
0.100 |
23 |
|
A |
16 |
6 |
10075 |
f |
[LI1]A:608 |
-y+2,x-y+1,z |
2_765 |
9 |
1 |
568 |
111.9 |
-2.8 |
0.595 |
0 |
0 |
0 |
0.038 |
24 |
|
A |
13 |
6 |
10075 |
◊ |
[LI1]A:603 |
-y+2,x-y+1,z |
2_765 |
13 |
1 |
572 |
111.0 |
-1.8 |
0.631 |
0 |
0 |
0 |
0.025 |
25 |
|
[LI1]A:607 |
14 |
1 |
1051 |
x |
[LI1]A:607 |
-y+1,x-y+1,z |
2_665 |
11 |
1 |
1051 |
107.2 |
-1.3 |
0.709 |
0 |
0 |
0 |
0.017 |
26 |
|
[LI1]A:604 |
13 |
1 |
527 |
◊ |
A |
-y+2,x-y+1,z |
2_765 |
7 |
3 |
10075 |
98.7 |
-2.6 |
0.254 |
0 |
0 |
0 |
0.032 |
27 |
|
A |
9 |
4 |
10075 |
◊ |
[LI1]A:601 |
-y+2,x-y+1,z |
2_765 |
10 |
1 |
742 |
98.6 |
-1.5 |
0.375 |
0 |
0 |
0 |
0.020 |
28 |
|
[LI1]A:603 |
12 |
1 |
572 |
f |
[LI1]A:602 |
x,y,z |
1_555 |
12 |
1 |
878 |
97.1 |
-1.0 |
0.889 |
0 |
0 |
0 |
0.014 |
29 |
|
[LI1]A:609 |
10 |
1 |
540 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
10075 |
91.1 |
-2.0 |
0.307 |
0 |
0 |
0 |
0.027 |
30 |
|
[LI1]A:611 |
11 |
1 |
534 |
◊ |
[SQU]A:701 |
-y+1,x-y,z |
2_655 |
11 |
1 |
707 |
88.4 |
2.5 |
0.625 |
0 |
0 |
0 |
0.000 |
31 |
|
[LI1]A:610 |
9 |
1 |
894 |
x |
[LI1]A:610 |
-y+2,x-y+1,z |
2_765 |
10 |
1 |
894 |
88.4 |
-2.5 |
0.615 |
0 |
0 |
0 |
0.034 |
32 |
|
[LI1]A:608 |
6 |
1 |
568 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
10075 |
86.2 |
-1.6 |
0.595 |
0 |
0 |
0 |
0.021 |
33 |
|
[LI1]A:601 |
15 |
1 |
742 |
◊ |
[LI1]A:606 |
-y+1,x-y+1,z |
2_665 |
7 |
1 |
319 |
84.6 |
-1.4 |
0.778 |
0 |
0 |
0 |
0.018 |
34 |
|
A |
11 |
4 |
10075 |
◊ |
[LI1]A:602 |
x-y+1,x,z+1/2 |
6_655 |
7 |
1 |
878 |
77.8 |
0.8 |
0.835 |
0 |
0 |
0 |
0.000 |
35 |
|
[LI1]A:607 |
4 |
1 |
1051 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
7 |
5 |
10075 |
69.4 |
0.9 |
0.559 |
0 |
0 |
0 |
0.000 |
36 |
|
[SQU]A:701 |
5 |
1 |
707 |
◊ |
[LI1]A:601 |
-y+2,x-y+1,z |
2_765 |
3 |
1 |
742 |
64.8 |
0.8 |
0.413 |
0 |
0 |
0 |
0.000 |
37 |
|
[LI1]A:604 |
10 |
1 |
527 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
10075 |
62.0 |
-1.6 |
0.687 |
0 |
0 |
0 |
0.020 |
38 |
|
[LI1]A:605 |
6 |
1 |
319 |
fx |
[LI1]A:605 |
-y+1,x-y,z |
2_655 |
5 |
1 |
319 |
61.1 |
-1.8 |
0.821 |
0 |
0 |
0 |
0.100 |
39 |
|
[LI1]A:608 |
6 |
1 |
568 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
6 |
3 |
10075 |
60.0 |
-0.6 |
0.430 |
0 |
0 |
0 |
0.000 |
40 |
|
[LI1]A:610 |
8 |
1 |
894 |
◊ |
[LI1]A:604 |
x,y,z |
1_555 |
4 |
1 |
527 |
53.3 |
0.1 |
0.836 |
0 |
0 |
0 |
0.000 |
41 |
|
[LI1]A:605 |
4 |
1 |
319 |
◊ |
[LI1]A:606 |
-y+1,x-y,z |
2_655 |
6 |
1 |
319 |
51.0 |
-0.7 |
0.847 |
0 |
0 |
0 |
0.000 |
42 |
|
[LI1]A:605 |
5 |
1 |
319 |
◊ |
A |
-y+1,x-y,z |
2_655 |
4 |
2 |
10075 |
48.3 |
-0.8 |
0.422 |
0 |
0 |
0 |
0.000 |
43 |
|
[LI1]A:602 |
4 |
1 |
878 |
f |
[LI1]A:601 |
x,y,z |
1_555 |
9 |
1 |
742 |
47.0 |
-1.3 |
0.560 |
0 |
0 |
0 |
0.017 |
44 |
|
A |
4 |
2 |
10075 |
x |
A |
-y+1,x-y,z |
2_655 |
3 |
1 |
10075 |
46.9 |
0.5 |
0.469 |
0 |
0 |
0 |
0.000 |
45 |
|
[LI1]A:605 |
4 |
1 |
319 |
◊ |
[LI1]A:611 |
-y+1,x-y,z |
2_655 |
4 |
1 |
534 |
46.4 |
-0.2 |
0.724 |
0 |
0 |
0 |
0.000 |
46 |
|
[LI1]A:608 |
2 |
1 |
568 |
◊ |
[LI1]A:602 |
x,y,z |
1_555 |
4 |
1 |
878 |
45.3 |
-1.4 |
0.513 |
0 |
0 |
0 |
0.020 |
47 |
|
[LI1]A:608 |
4 |
1 |
568 |
◊ |
[LI1]A:601 |
x,y,z |
1_555 |
2 |
1 |
742 |
45.0 |
-1.3 |
0.393 |
0 |
0 |
0 |
0.017 |
48 |
|
[LI1]A:610 |
4 |
1 |
894 |
◊ |
A |
-y+2,x-y+1,z |
2_765 |
5 |
4 |
10075 |
44.8 |
-1.3 |
0.459 |
0 |
0 |
0 |
0.018 |
49 |
|
[LI1]A:606 |
4 |
1 |
319 |
f |
[LI1]A:611 |
x,y,z |
1_555 |
3 |
1 |
534 |
40.2 |
-0.8 |
0.710 |
0 |
0 |
0 |
0.011 |
50 |
|
[LI1]A:611 |
4 |
1 |
534 |
◊ |
A |
-y+1,x-y,z |
2_655 |
4 |
3 |
10075 |
38.6 |
0.4 |
0.493 |
0 |
0 |
0 |
0.000 |
51 |
|
[LI1]A:610 |
4 |
1 |
894 |
◊ |
[LI1]A:603 |
-y+2,x-y+1,z |
2_765 |
4 |
1 |
572 |
36.1 |
-1.1 |
0.665 |
0 |
0 |
0 |
0.016 |
52 |
|
A |
4 |
2 |
10075 |
◊ |
[SQU]A:701 |
-y+1,x-y,z |
2_655 |
5 |
1 |
707 |
35.6 |
-0.3 |
0.389 |
0 |
0 |
0 |
0.000 |
53 |
|
[LI1]A:601 |
3 |
1 |
742 |
◊ |
[LI1]A:611 |
-y+1,x-y+1,z |
2_665 |
3 |
1 |
534 |
32.8 |
-0.9 |
0.550 |
0 |
0 |
0 |
0.012 |
54 |
|
[LI1]A:605 |
3 |
1 |
319 |
◊ |
[LI1]A:601 |
x,y-1,z |
1_545 |
5 |
1 |
742 |
30.7 |
-0.4 |
0.708 |
0 |
0 |
0 |
0.000 |
55 |
|
[LI1]A:604 |
3 |
1 |
527 |
◊ |
[LI1]A:610 |
-y+2,x-y+1,z |
2_765 |
4 |
1 |
894 |
30.4 |
-1.0 |
0.621 |
0 |
0 |
0 |
0.012 |
56 |
|
[LI1]A:601 |
1 |
1 |
742 |
◊ |
[LI1]A:612 |
-y+1,x-y+1,z |
2_665 |
3 |
1 |
567 |
26.8 |
-0.9 |
0.417 |
0 |
0 |
0 |
0.011 |
57 |
|
[LI1]A:609 |
2 |
1 |
540 |
f |
[LI1]A:603 |
x,y,z |
1_555 |
3 |
1 |
572 |
26.5 |
0.0 |
0.762 |
0 |
0 |
0 |
0.000 |
58 |
|
[LI1]A:609 |
3 |
1 |
540 |
◊ |
[LI1]A:608 |
x,y,z |
1_555 |
3 |
1 |
568 |
25.4 |
-0.8 |
0.614 |
0 |
0 |
0 |
0.010 |
59 |
|
[LI1]A:613 |
1 |
1 |
436 |
◊ |
[LI1]A:607 |
x,y,z |
1_555 |
2 |
1 |
1051 |
22.5 |
0.4 |
0.705 |
0 |
0 |
0 |
0.000 |
60 |
|
[LI1]A:613 |
1 |
1 |
436 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
2 |
1 |
10075 |
21.3 |
0.4 |
0.493 |
0 |
0 |
0 |
0.000 |
61 |
|
A |
2 |
1 |
10075 |
x |
A |
-y+2,x-y+1,z |
2_765 |
2 |
1 |
10075 |
20.0 |
-0.6 |
0.328 |
0 |
0 |
0 |
0.009 |
62 |
|
[SQU]A:701 |
1 |
1 |
707 |
◊ |
[LI1]A:609 |
-y+2,x-y+1,z |
2_765 |
3 |
1 |
540 |
15.4 |
-0.5 |
0.493 |
0 |
0 |
0 |
0.007 |
63 |
|
[SQU]A:701 |
2 |
1 |
707 |
◊ |
[LI1]A:602 |
-y+2,x-y+1,z |
2_765 |
1 |
1 |
878 |
15.3 |
0.2 |
0.546 |
0 |
0 |
0 |
0.000 |
64 |
|
[LI1]A:613 |
3 |
1 |
436 |
◊ |
[LI1]A:607 |
-y+1,x-y+1,z |
2_665 |
3 |
1 |
1051 |
13.2 |
0.2 |
0.591 |
0 |
0 |
0 |
0.000 |
65 |
|
[SQU]A:701 |
2 |
1 |
707 |
◊ |
[LI1]A:611 |
x,y,z |
1_555 |
2 |
1 |
534 |
10.7 |
-0.3 |
0.528 |
0 |
0 |
0 |
0.005 |
66 |
|
A |
2 |
1 |
10075 |
◊ |
[LI1]A:613 |
-y+1,x-y+1,z |
2_665 |
3 |
1 |
436 |
9.9 |
-0.3 |
0.447 |
0 |
0 |
0 |
0.004 |
67 |
|
[LI1]A:606 |
1 |
1 |
319 |
f |
[LI1]A:612 |
x,y,z |
1_555 |
1 |
1 |
567 |
9.5 |
-0.3 |
0.854 |
0 |
0 |
0 |
0.004 |
68 |
|
[LI1]A:610 |
1 |
1 |
894 |
f |
[LI1]A:603 |
x,y,z |
1_555 |
1 |
1 |
572 |
8.5 |
-0.3 |
0.722 |
0 |
0 |
0 |
0.004 |
69 |
|
A |
1 |
1 |
10075 |
◊ |
[LI1]A:605 |
-y+1,x-y,z |
2_655 |
1 |
1 |
319 |
7.8 |
-0.2 |
0.527 |
0 |
0 |
0 |
0.000 |
70 |
|
[LI1]A:611 |
1 |
1 |
534 |
x |
[LI1]A:611 |
-y+1,x-y,z |
2_655 |
2 |
1 |
534 |
7.3 |
-0.2 |
0.726 |
0 |
0 |
0 |
0.000 |
71 |
|
A |
1 |
1 |
10075 |
x |
A |
x-y+1,x,z-1/2 |
6_654 |
2 |
1 |
10075 |
7.1 |
-0.0 |
0.545 |
0 |
0 |
0 |
0.000 |
72 |
|
[LI1]A:608 |
1 |
1 |
568 |
◊ |
[LI1]A:611 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
534 |
7.0 |
0.5 |
0.800 |
0 |
0 |
0 |
0.000 |
73 |
|
[LI1]A:607 |
1 |
1 |
1051 |
◊ |
[LI1]A:613 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
436 |
4.7 |
0.1 |
0.714 |
0 |
0 |
0 |
0.000 |
74 |
|
[LI1]A:609 |
1 |
1 |
540 |
f |
[LI1]A:602 |
x,y,z |
1_555 |
1 |
1 |
878 |
2.3 |
-0.1 |
0.781 |
0 |
0 |
0 |
0.001 |
75 |
|
[SQU]A:701 |
1 |
1 |
707 |
◊ |
A |
-y+2,x-y+1,z |
2_765 |
1 |
1 |
10075 |
0.7 |
-0.0 |
0.597 |
0 |
0 |
0 |
0.000 |
|