| ## |
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 |
77 |
24 |
9881 |
x |
A |
-y+1,x-y+1,z |
2_665 |
68 |
22 |
9881 |
655.5 |
-13.8 |
0.339 |
2 |
1 |
0 |
0.192 |
2 |
|
A |
50 |
16 |
9881 |
f |
[LI1]A:607 |
-y+1,x-y+1,z |
2_665 |
31 |
1 |
1014 |
366.7 |
-7.0 |
0.540 |
0 |
0 |
0 |
0.091 |
3 |
|
[RET]A:301 |
19 |
1 |
542 |
cf |
A |
x,y,z |
1_555 |
58 |
18 |
9881 |
352.7 |
-1.0 |
0.683 |
0 |
0 |
0 |
0.013 |
4 |
|
[LI1]A:610 |
30 |
1 |
925 |
f |
A |
x,y,z |
1_555 |
33 |
11 |
9881 |
324.5 |
-4.7 |
0.767 |
0 |
0 |
0 |
0.061 |
5 |
|
[SQU]A:701 |
24 |
1 |
697 |
◊ |
A |
x,y,z |
1_555 |
38 |
13 |
9881 |
289.8 |
-1.1 |
0.427 |
0 |
0 |
0 |
0.000 |
6 |
|
[LI1]A:602 |
31 |
1 |
951 |
◊ |
A |
x,y,z |
1_555 |
33 |
9 |
9881 |
279.0 |
-4.5 |
0.659 |
0 |
0 |
0 |
0.057 |
7 |
|
[LI1]A:612 |
17 |
1 |
563 |
f |
A |
x,y,z |
1_555 |
43 |
14 |
9881 |
265.3 |
-7.5 |
0.590 |
0 |
0 |
0 |
0.097 |
8 |
|
A |
23 |
10 |
9881 |
f |
[LI1]A:602 |
-y+2,x-y+1,z |
2_765 |
24 |
1 |
951 |
254.9 |
-6.4 |
0.349 |
0 |
0 |
0 |
0.083 |
9 |
|
[LI1]A:607 |
19 |
1 |
1014 |
◊ |
A |
x,y,z |
1_555 |
31 |
9 |
9881 |
234.7 |
-5.1 |
0.537 |
0 |
0 |
0 |
0.065 |
10 |
|
[LI1]A:613 |
13 |
1 |
439 |
◊ |
A |
x,y,z |
1_555 |
27 |
8 |
9881 |
215.3 |
-2.0 |
0.424 |
0 |
0 |
0 |
0.000 |
11 |
|
A |
27 |
10 |
9881 |
◊ |
[LI1]A:609 |
-y+2,x-y+1,z |
2_765 |
14 |
1 |
531 |
208.7 |
-3.8 |
0.690 |
0 |
0 |
0 |
0.048 |
12 |
|
[LI1]A:611 |
13 |
1 |
518 |
f |
A |
x,y,z |
1_555 |
24 |
5 |
9881 |
178.4 |
-3.0 |
0.513 |
0 |
0 |
0 |
0.038 |
13 |
|
[LI1]A:603 |
15 |
1 |
565 |
f |
A |
x,y,z |
1_555 |
21 |
12 |
9881 |
166.7 |
-4.3 |
0.478 |
0 |
0 |
0 |
0.055 |
14 |
|
A |
32 |
10 |
9881 |
◊ |
[LI1]A:612 |
-y+1,x-y+1,z |
2_665 |
16 |
1 |
563 |
165.9 |
-2.3 |
0.854 |
0 |
0 |
0 |
0.029 |
15 |
|
[SQU]A:701 |
21 |
1 |
697 |
◊ |
[LI1]A:608 |
-y+2,x-y+1,z |
2_765 |
13 |
1 |
574 |
150.6 |
-0.3 |
0.367 |
0 |
0 |
0 |
0.000 |
16 |
|
[LI1]A:601 |
11 |
1 |
747 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
9881 |
140.0 |
-2.8 |
0.368 |
0 |
0 |
0 |
0.036 |
17 |
|
[LI1]A:610 |
16 |
1 |
925 |
◊ |
[LI1]A:609 |
-y+2,x-y+1,z |
2_765 |
12 |
1 |
531 |
130.3 |
-2.1 |
0.779 |
0 |
0 |
0 |
0.026 |
18 |
|
[LI1]A:606 |
8 |
1 |
318 |
f |
A |
x,y,z |
1_555 |
17 |
10 |
9881 |
119.9 |
-3.2 |
0.610 |
0 |
0 |
0 |
0.041 |
19 |
|
[LI1]A:604 |
11 |
1 |
528 |
◊ |
[LI1]A:603 |
-y+2,x-y+1,z |
2_765 |
11 |
1 |
565 |
119.1 |
-1.4 |
0.870 |
0 |
0 |
0 |
0.017 |
20 |
|
[LI1]A:601 |
13 |
1 |
747 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
12 |
6 |
9881 |
118.2 |
-2.3 |
0.366 |
0 |
0 |
0 |
0.030 |
21 |
|
[LI1]A:607 |
18 |
1 |
1014 |
x |
[LI1]A:607 |
-y+1,x-y+1,z |
2_665 |
9 |
1 |
1014 |
117.1 |
-1.4 |
0.710 |
0 |
0 |
0 |
0.018 |
22 |
|
A |
13 |
6 |
9881 |
◊ |
[LI1]A:603 |
-y+2,x-y+1,z |
2_765 |
12 |
1 |
565 |
111.9 |
-1.9 |
0.626 |
0 |
0 |
0 |
0.024 |
23 |
|
[LI1]A:604 |
12 |
1 |
528 |
x |
[LI1]A:604 |
-y+2,x-y+1,z |
2_765 |
10 |
1 |
528 |
110.0 |
-1.8 |
0.813 |
0 |
0 |
0 |
0.023 |
24 |
|
[LI1]A:604 |
12 |
1 |
528 |
◊ |
A |
-y+2,x-y+1,z |
2_765 |
8 |
3 |
9881 |
104.4 |
-2.1 |
0.231 |
0 |
0 |
0 |
0.027 |
25 |
|
[LI1]A:605 |
7 |
1 |
313 |
◊ |
A |
-y+1,x-y,z |
2_655 |
13 |
6 |
9881 |
103.0 |
-2.2 |
0.606 |
0 |
0 |
0 |
0.000 |
26 |
|
A |
17 |
5 |
9881 |
◊ |
[LI1]A:608 |
-y+2,x-y+1,z |
2_765 |
9 |
1 |
574 |
102.7 |
-3.0 |
0.544 |
0 |
0 |
0 |
0.039 |
27 |
|
[LI1]A:608 |
7 |
1 |
574 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
9881 |
98.1 |
-2.2 |
0.543 |
0 |
0 |
0 |
0.028 |
28 |
|
[LI1]A:601 |
14 |
1 |
747 |
◊ |
[LI1]A:606 |
-y+1,x-y+1,z |
2_665 |
7 |
1 |
318 |
95.3 |
-1.9 |
0.750 |
0 |
0 |
0 |
0.025 |
29 |
|
[LI1]A:603 |
11 |
1 |
565 |
◊ |
[LI1]A:602 |
x,y,z |
1_555 |
10 |
1 |
951 |
91.1 |
-0.9 |
0.856 |
0 |
0 |
0 |
0.011 |
30 |
|
A |
11 |
4 |
9881 |
◊ |
[LI1]A:602 |
x-y+1,x,z+1/2 |
6_655 |
6 |
1 |
951 |
86.3 |
0.1 |
0.776 |
1 |
0 |
0 |
0.000 |
31 |
|
A |
9 |
4 |
9881 |
◊ |
[LI1]A:601 |
-y+2,x-y+1,z |
2_765 |
8 |
1 |
747 |
85.9 |
-0.9 |
0.440 |
0 |
0 |
0 |
0.012 |
32 |
|
[LI1]A:610 |
8 |
1 |
925 |
x |
[LI1]A:610 |
-y+2,x-y+1,z |
2_765 |
10 |
1 |
925 |
85.8 |
-1.6 |
0.678 |
0 |
0 |
0 |
0.021 |
33 |
|
A |
12 |
4 |
9881 |
x |
A |
x-y+1,x,z+1/2 |
6_655 |
9 |
3 |
9881 |
85.5 |
-1.6 |
0.605 |
1 |
0 |
0 |
0.000 |
34 |
|
[LI1]A:609 |
8 |
1 |
531 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
9881 |
78.1 |
-2.0 |
0.238 |
0 |
0 |
0 |
0.025 |
35 |
|
[SQU]A:701 |
6 |
1 |
697 |
◊ |
[LI1]A:601 |
-y+2,x-y+1,z |
2_765 |
8 |
1 |
747 |
77.5 |
1.2 |
0.611 |
0 |
0 |
0 |
0.000 |
36 |
|
[LI1]A:604 |
9 |
1 |
528 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
9881 |
70.5 |
-1.9 |
0.595 |
0 |
0 |
0 |
0.025 |
37 |
|
[LI1]A:607 |
4 |
1 |
1014 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
6 |
4 |
9881 |
69.0 |
0.8 |
0.464 |
0 |
0 |
0 |
0.000 |
38 |
|
[LI1]A:605 |
8 |
1 |
313 |
◊ |
[LI1]A:606 |
-y+1,x-y,z |
2_655 |
7 |
1 |
318 |
66.9 |
-0.3 |
0.963 |
0 |
0 |
0 |
0.000 |
39 |
|
[LI1]A:608 |
8 |
1 |
574 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
6 |
3 |
9881 |
65.0 |
-0.7 |
0.379 |
0 |
0 |
0 |
0.009 |
40 |
|
[LI1]A:611 |
8 |
1 |
518 |
◊ |
[SQU]A:701 |
-y+1,x-y,z |
2_655 |
12 |
1 |
697 |
61.8 |
1.3 |
0.441 |
0 |
0 |
0 |
0.000 |
41 |
|
[LI1]A:610 |
8 |
1 |
925 |
f |
[LI1]A:604 |
x,y,z |
1_555 |
4 |
1 |
528 |
58.6 |
-0.5 |
0.794 |
0 |
0 |
0 |
0.007 |
42 |
|
[LI1]A:602 |
3 |
1 |
951 |
◊ |
[LI1]A:601 |
x,y,z |
1_555 |
7 |
1 |
747 |
47.5 |
-1.4 |
0.466 |
0 |
0 |
0 |
0.017 |
43 |
|
[LI1]A:608 |
6 |
1 |
574 |
f |
[LI1]A:601 |
x,y,z |
1_555 |
3 |
1 |
747 |
45.7 |
-0.7 |
0.525 |
0 |
0 |
0 |
0.009 |
44 |
|
[LI1]A:610 |
5 |
1 |
925 |
◊ |
[LI1]A:603 |
-y+2,x-y+1,z |
2_765 |
4 |
1 |
565 |
44.6 |
-1.4 |
0.624 |
0 |
0 |
0 |
0.018 |
45 |
|
[LI1]A:601 |
5 |
1 |
747 |
◊ |
[LI1]A:612 |
-y+1,x-y+1,z |
2_665 |
5 |
1 |
563 |
43.7 |
-1.3 |
0.599 |
0 |
0 |
0 |
0.017 |
46 |
|
[SQU]A:701 |
4 |
1 |
697 |
◊ |
[LI1]A:602 |
-y+2,x-y+1,z |
2_765 |
3 |
1 |
951 |
43.5 |
0.5 |
0.542 |
0 |
0 |
0 |
0.000 |
47 |
|
[LI1]A:611 |
5 |
1 |
518 |
◊ |
A |
-y+1,x-y,z |
2_655 |
4 |
3 |
9881 |
40.0 |
-0.4 |
0.438 |
0 |
0 |
0 |
0.000 |
48 |
|
A |
4 |
2 |
9881 |
◊ |
[SQU]A:701 |
-y+1,x-y,z |
2_655 |
4 |
1 |
697 |
39.7 |
-0.5 |
0.337 |
0 |
0 |
0 |
0.000 |
49 |
|
[LI1]A:604 |
4 |
1 |
528 |
◊ |
[LI1]A:610 |
-y+2,x-y+1,z |
2_765 |
3 |
1 |
925 |
36.8 |
-1.0 |
0.629 |
0 |
0 |
0 |
0.013 |
50 |
|
A |
4 |
2 |
9881 |
x |
A |
-y+1,x-y,z |
2_655 |
4 |
1 |
9881 |
34.1 |
-0.1 |
0.477 |
0 |
0 |
0 |
0.000 |
51 |
|
[LI1]A:608 |
2 |
1 |
574 |
◊ |
[LI1]A:602 |
x,y,z |
1_555 |
5 |
1 |
951 |
33.5 |
-1.1 |
0.607 |
0 |
0 |
0 |
0.014 |
52 |
|
[LI1]A:605 |
2 |
1 |
313 |
◊ |
[LI1]A:611 |
-y+1,x-y,z |
2_655 |
2 |
1 |
518 |
24.2 |
-0.8 |
0.681 |
0 |
0 |
0 |
0.000 |
53 |
|
[LI1]A:601 |
4 |
1 |
747 |
◊ |
[LI1]A:605 |
-y+1,x-y+1,z |
2_665 |
2 |
1 |
313 |
23.8 |
-0.3 |
0.733 |
0 |
0 |
0 |
0.004 |
54 |
|
[LI1]A:601 |
1 |
1 |
747 |
◊ |
[LI1]A:611 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
518 |
20.4 |
0.3 |
0.621 |
0 |
0 |
0 |
0.000 |
55 |
|
[LI1]A:605 |
1 |
1 |
313 |
f |
[LI1]A:611 |
x,y,z |
1_555 |
1 |
1 |
518 |
19.9 |
-0.6 |
0.681 |
0 |
0 |
0 |
0.008 |
56 |
|
[LI1]A:610 |
2 |
1 |
925 |
f |
[LI1]A:603 |
x,y,z |
1_555 |
2 |
1 |
565 |
19.7 |
-0.6 |
0.669 |
0 |
0 |
0 |
0.008 |
57 |
|
[LI1]A:613 |
2 |
1 |
439 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
2 |
1 |
9881 |
19.3 |
0.4 |
0.463 |
0 |
0 |
0 |
0.000 |
58 |
|
[SQU]A:701 |
1 |
1 |
697 |
◊ |
[LI1]A:609 |
-y+2,x-y+1,z |
2_765 |
2 |
1 |
531 |
17.2 |
-0.5 |
0.469 |
0 |
0 |
0 |
0.000 |
59 |
|
[LI1]A:609 |
3 |
1 |
531 |
f |
[LI1]A:608 |
x,y,z |
1_555 |
3 |
1 |
574 |
15.6 |
-0.3 |
0.644 |
0 |
0 |
0 |
0.004 |
60 |
|
[LI1]A:613 |
1 |
1 |
439 |
◊ |
[LI1]A:607 |
x,y,z |
1_555 |
2 |
1 |
1014 |
13.9 |
0.2 |
0.680 |
0 |
0 |
0 |
0.000 |
61 |
|
[LI1]A:613 |
3 |
1 |
439 |
◊ |
[LI1]A:607 |
-y+1,x-y+1,z |
2_665 |
2 |
1 |
1014 |
13.8 |
0.2 |
0.591 |
0 |
0 |
0 |
0.000 |
62 |
|
[LI1]A:611 |
1 |
1 |
518 |
x |
[LI1]A:611 |
-y+1,x-y,z |
2_655 |
1 |
1 |
518 |
13.4 |
-0.4 |
0.647 |
0 |
0 |
0 |
0.000 |
63 |
|
A |
3 |
2 |
9881 |
x |
A |
-y+2,x-y+1,z |
2_765 |
3 |
2 |
9881 |
13.4 |
-0.4 |
0.549 |
0 |
0 |
0 |
0.005 |
64 |
|
[LI1]A:605 |
2 |
1 |
313 |
◊ |
[LI1]A:601 |
x,y-1,z |
1_545 |
4 |
1 |
747 |
12.0 |
-0.4 |
0.716 |
0 |
0 |
0 |
0.000 |
65 |
|
[LI1]A:612 |
1 |
1 |
563 |
◊ |
[SQU]A:701 |
-y+1,x-y,z |
2_655 |
1 |
1 |
697 |
11.6 |
0.2 |
0.720 |
0 |
0 |
0 |
0.000 |
66 |
|
[LI1]A:608 |
1 |
1 |
574 |
◊ |
[LI1]A:611 |
-y+1,x-y+1,z |
2_665 |
4 |
1 |
518 |
11.4 |
0.7 |
0.732 |
0 |
0 |
0 |
0.000 |
67 |
|
[LI1]A:610 |
3 |
1 |
925 |
◊ |
A |
-y+2,x-y+1,z |
2_765 |
5 |
3 |
9881 |
11.3 |
-0.4 |
0.714 |
0 |
0 |
0 |
0.005 |
68 |
|
[LI1]A:607 |
1 |
1 |
1014 |
◊ |
[LI1]A:613 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
439 |
9.2 |
0.2 |
0.714 |
0 |
0 |
0 |
0.000 |
69 |
|
[LI1]A:606 |
2 |
1 |
318 |
f |
[LI1]A:611 |
x,y,z |
1_555 |
3 |
1 |
518 |
7.8 |
-0.1 |
0.710 |
0 |
0 |
0 |
0.001 |
70 |
|
[LI1]A:609 |
2 |
1 |
531 |
f |
[LI1]A:603 |
x,y,z |
1_555 |
2 |
1 |
565 |
6.1 |
0.1 |
0.713 |
0 |
0 |
0 |
0.000 |
71 |
|
[LI1]A:605 |
2 |
1 |
313 |
x |
[LI1]A:605 |
-y+1,x-y,z |
2_655 |
1 |
1 |
313 |
5.9 |
-0.2 |
0.851 |
0 |
0 |
0 |
0.000 |
72 |
|
[LI1]A:610 |
1 |
1 |
925 |
f |
[LI1]A:609 |
x,y,z |
1_555 |
1 |
1 |
531 |
4.5 |
-0.1 |
0.781 |
0 |
0 |
0 |
0.002 |
73 |
|
[LI1]A:613 |
2 |
1 |
439 |
fx |
[LI1]A:613 |
-y+1,x-y+1,z |
2_665 |
2 |
1 |
439 |
4.2 |
0.2 |
0.520 |
0 |
0 |
0 |
0.000 |
74 |
|
A |
1 |
1 |
9881 |
◊ |
[LI1]A:613 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
439 |
3.4 |
-0.1 |
0.558 |
0 |
0 |
0 |
0.000 |
75 |
|
[LI1]A:606 |
1 |
1 |
318 |
f |
[LI1]A:612 |
x,y,z |
1_555 |
1 |
1 |
563 |
2.5 |
-0.1 |
0.854 |
0 |
0 |
0 |
0.001 |
76 |
|
[SQU]A:701 |
2 |
1 |
697 |
◊ |
A |
-y+2,x-y+1,z |
2_765 |
2 |
2 |
9881 |
2.2 |
-0.0 |
0.546 |
0 |
0 |
0 |
0.000 |
77 |
|
A |
1 |
1 |
9881 |
x |
A |
x-y+1,x,z-1/2 |
6_654 |
2 |
1 |
9881 |
0.8 |
-0.0 |
0.699 |
0 |
0 |
0 |
0.000 |
78 |
|
A |
1 |
1 |
9881 |
◊ |
[LI1]A:604 |
-y+2,x-y+1,z |
2_765 |
1 |
1 |
528 |
0.6 |
-0.0 |
0.724 |
0 |
0 |
0 |
0.000 |
|