## |
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 |
|
E |
100 |
9 |
2653 |
◊ |
D |
x,y,z |
1_555 |
133 |
42 |
18826 |
1039.3 |
-13.3 |
0.421 |
13 |
0 |
0 |
0.160 |
2 |
|
B |
96 |
9 |
2648 |
◊ |
A |
x,y,z |
1_555 |
130 |
41 |
18789 |
1016.5 |
-14.1 |
0.367 |
16 |
0 |
0 |
0.160 |
Average: |
1027.9 |
-13.7 |
0.394 |
15 |
0 |
0 |
0.160 |
2 |
3 |
|
F |
95 |
9 |
2467 |
◊ |
D |
x,y,z |
1_555 |
100 |
32 |
18826 |
853.8 |
-2.4 |
0.623 |
16 |
0 |
0 |
0.064 |
4 |
|
C |
92 |
9 |
2464 |
◊ |
A |
x,y,z |
1_555 |
97 |
33 |
18789 |
845.3 |
-1.1 |
0.666 |
17 |
0 |
0 |
0.064 |
Average: |
849.6 |
-1.7 |
0.644 |
17 |
0 |
0 |
0.064 |
3 |
5 |
|
D |
65 |
17 |
18826 |
x |
D |
x-1,y,z |
1_455 |
57 |
18 |
18826 |
595.4 |
-8.3 |
0.019 |
0 |
0 |
0 |
0.000 |
6 |
|
A |
55 |
17 |
18789 |
x |
A |
x-1,y,z |
1_455 |
62 |
18 |
18789 |
552.5 |
-8.6 |
0.031 |
0 |
0 |
0 |
0.000 |
Average: |
574.0 |
-8.5 |
0.025 |
0 |
0 |
0 |
0.000 |
4 |
7 |
|
F |
48 |
9 |
2467 |
◊ |
E |
x,y,z |
1_555 |
53 |
9 |
2653 |
500.4 |
-7.5 |
0.503 |
19 |
0 |
0 |
1.000 |
8 |
|
C |
47 |
9 |
2464 |
◊ |
B |
x,y,z |
1_555 |
54 |
9 |
2648 |
490.9 |
-7.1 |
0.498 |
20 |
0 |
0 |
1.000 |
Average: |
495.6 |
-7.3 |
0.500 |
20 |
0 |
0 |
1.000 |
5 |
9 |
|
A |
36 |
11 |
18789 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
35 |
9 |
18826 |
345.8 |
3.0 |
0.835 |
6 |
2 |
0 |
0.000 |
6 |
10 |
|
[BA2]D:1416 |
25 |
1 |
619 |
f |
D |
x,y,z |
1_555 |
46 |
20 |
18826 |
306.9 |
-1.5 |
0.386 |
1 |
0 |
0 |
0.015 |
11 |
|
[BA2]A:1415 |
22 |
1 |
541 |
f |
A |
x,y,z |
1_555 |
47 |
19 |
18789 |
287.1 |
-1.5 |
0.337 |
1 |
0 |
0 |
0.015 |
Average: |
297.0 |
-1.5 |
0.361 |
1 |
0 |
0 |
0.015 |
7 |
12 |
|
A |
30 |
9 |
18789 |
◊ |
D |
x-1,y,z-1 |
1_454 |
41 |
13 |
18826 |
295.9 |
-0.8 |
0.368 |
4 |
3 |
0 |
0.000 |
8 |
13 |
|
D |
30 |
11 |
18826 |
◊ |
A |
x,y,z |
1_555 |
36 |
12 |
18789 |
295.3 |
-1.7 |
0.357 |
2 |
4 |
0 |
0.000 |
9 |
14 |
|
A |
28 |
7 |
18789 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
9 |
18826 |
258.7 |
1.1 |
0.704 |
6 |
0 |
0 |
0.000 |
10 |
15 |
|
[6MA]F:18 |
19 |
1 |
478 |
cf |
F |
x,y,z |
1_555 |
32 |
2 |
2467 |
232.0 |
6.6 |
0.669 |
0 |
0 |
0 |
0.000 |
16 |
|
[6MA]C:18 |
20 |
1 |
477 |
cf |
C |
x,y,z |
1_555 |
32 |
2 |
2464 |
225.2 |
6.3 |
0.670 |
1 |
0 |
0 |
0.000 |
Average: |
228.6 |
6.5 |
0.670 |
1 |
0 |
0 |
0.000 |
11 |
17 |
|
D |
28 |
9 |
18826 |
x |
D |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
8 |
18826 |
209.8 |
1.3 |
0.602 |
3 |
3 |
0 |
0.000 |
12 |
18 |
|
A |
26 |
8 |
18789 |
x |
A |
-x,y-1/2,-z |
2_545 |
30 |
12 |
18789 |
201.1 |
-1.4 |
0.451 |
0 |
0 |
0 |
0.000 |
13 |
19 |
|
[6MA]F:18 |
17 |
1 |
478 |
◊ |
D |
x,y,z |
1_555 |
23 |
8 |
18826 |
167.3 |
1.9 |
0.390 |
2 |
0 |
0 |
0.000 |
20 |
|
[6MA]C:18 |
17 |
1 |
477 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
18789 |
161.3 |
1.7 |
0.400 |
2 |
0 |
0 |
0.000 |
Average: |
164.3 |
1.8 |
0.395 |
2 |
0 |
0 |
0.000 |
14 |
21 |
|
A |
19 |
7 |
18789 |
◊ |
D |
x-1,y,z |
1_455 |
22 |
9 |
18826 |
156.3 |
-0.1 |
0.564 |
2 |
2 |
0 |
0.000 |
15 |
22 |
|
[GOL]A:1416 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
18 |
11 |
18789 |
113.4 |
-1.3 |
0.352 |
1 |
0 |
0 |
0.013 |
16 |
23 |
|
C |
17 |
3 |
2464 |
x |
C |
-x,y-1/2,-z |
2_545 |
10 |
1 |
2464 |
109.1 |
2.4 |
0.729 |
1 |
0 |
0 |
0.000 |
17 |
24 |
|
A |
12 |
5 |
18789 |
◊ |
D |
x,y,z-1 |
1_554 |
15 |
6 |
18826 |
98.9 |
2.1 |
0.839 |
1 |
1 |
0 |
0.000 |
18 |
25 |
|
C |
13 |
1 |
2464 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
13 |
1 |
2648 |
89.0 |
1.3 |
0.695 |
0 |
0 |
0 |
0.000 |
19 |
26 |
|
[K]D:1415 |
1 |
1 |
216 |
f |
[BA2]D:1416 |
x,y,z |
1_555 |
10 |
1 |
619 |
86.3 |
-49.3 |
0.000 |
0 |
0 |
0 |
0.383 |
27 |
|
[K]B:1011 |
1 |
1 |
216 |
f |
[BA2]A:1415 |
x,y,z |
1_555 |
11 |
1 |
541 |
83.6 |
-48.9 |
0.000 |
0 |
0 |
0 |
0.383 |
Average: |
84.9 |
-49.1 |
0.000 |
0 |
0 |
0 |
0.383 |
20 |
28 |
|
F |
11 |
1 |
2467 |
◊ |
E |
-x+1,y-1/2,-z+1 |
2_646 |
11 |
1 |
2653 |
74.2 |
-0.3 |
0.565 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[GOL]B:1012 |
5 |
1 |
220 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
2648 |
68.7 |
-0.2 |
0.573 |
1 |
0 |
0 |
0.053 |
22 |
30 |
|
E |
12 |
1 |
2653 |
x |
E |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
1 |
2653 |
67.8 |
2.9 |
0.852 |
0 |
0 |
0 |
0.000 |
23 |
31 |
|
F |
7 |
1 |
2467 |
x |
F |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
2 |
2467 |
65.0 |
2.8 |
0.771 |
0 |
0 |
0 |
0.000 |
24 |
32 |
|
B |
8 |
1 |
2648 |
x |
B |
-x,y-1/2,-z |
2_545 |
11 |
2 |
2648 |
63.3 |
2.3 |
0.799 |
1 |
0 |
0 |
0.000 |
25 |
33 |
|
[6MA]F:18 |
5 |
1 |
478 |
◊ |
E |
x,y,z |
1_555 |
10 |
3 |
2653 |
63.1 |
-1.0 |
0.415 |
1 |
0 |
0 |
0.131 |
34 |
|
[6MA]C:18 |
5 |
1 |
477 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
2648 |
61.5 |
-0.8 |
0.419 |
1 |
0 |
0 |
0.131 |
Average: |
62.3 |
-0.9 |
0.417 |
1 |
0 |
0 |
0.131 |
26 |
35 |
|
[GOL]B:1012 |
4 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
9 |
2 |
2464 |
59.2 |
-0.4 |
0.396 |
1 |
0 |
0 |
0.067 |
27 |
36 |
|
[K]D:1415 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
18826 |
59.0 |
-35.9 |
0.000 |
0 |
0 |
0 |
0.279 |
37 |
|
[K]B:1011 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
18789 |
55.5 |
-34.5 |
0.000 |
0 |
0 |
0 |
0.279 |
Average: |
57.3 |
-35.2 |
0.000 |
0 |
0 |
0 |
0.279 |
28 |
38 |
|
[GOL]B:1012 |
5 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
18789 |
54.7 |
0.2 |
0.648 |
2 |
0 |
0 |
0.004 |
29 |
39 |
|
[GOL]A:1416 |
5 |
1 |
218 |
f |
[BA2]A:1415 |
x,y,z |
1_555 |
6 |
1 |
541 |
54.4 |
0.3 |
0.518 |
1 |
0 |
0 |
0.001 |
30 |
40 |
|
[K]B:1011 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
2648 |
51.7 |
-24.4 |
0.000 |
0 |
0 |
0 |
0.184 |
41 |
|
[K]D:1415 |
1 |
1 |
216 |
◊ |
E |
x,y,z |
1_555 |
5 |
1 |
2653 |
49.8 |
-22.5 |
0.000 |
0 |
0 |
0 |
0.184 |
Average: |
50.8 |
-23.4 |
0.000 |
0 |
0 |
0 |
0.184 |
31 |
42 |
|
[BA2]A:1415 |
3 |
1 |
541 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
2648 |
45.1 |
0.2 |
0.475 |
0 |
0 |
0 |
0.000 |
43 |
|
[BA2]D:1416 |
4 |
1 |
619 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
2653 |
41.3 |
0.2 |
0.556 |
0 |
0 |
0 |
0.000 |
Average: |
43.2 |
0.2 |
0.515 |
0 |
0 |
0 |
0.000 |
32 |
44 |
|
E |
5 |
1 |
2653 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
8 |
1 |
2467 |
40.3 |
-1.6 |
0.407 |
0 |
0 |
0 |
0.000 |
33 |
45 |
|
B |
5 |
1 |
2648 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
4 |
3 |
18789 |
29.1 |
-0.8 |
0.512 |
0 |
0 |
0 |
0.000 |
34 |
46 |
|
[GOL]A:1416 |
4 |
1 |
218 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
2 |
18789 |
26.5 |
0.0 |
0.584 |
0 |
0 |
0 |
0.000 |
35 |
47 |
|
C |
4 |
1 |
2464 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
2 |
18826 |
22.2 |
0.4 |
0.654 |
0 |
0 |
0 |
0.000 |
36 |
48 |
|
D |
4 |
2 |
18826 |
◊ |
E |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
2653 |
21.6 |
-0.7 |
0.351 |
0 |
0 |
0 |
0.000 |
37 |
49 |
|
D |
2 |
1 |
18826 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
2467 |
20.7 |
-1.2 |
0.259 |
0 |
0 |
0 |
0.000 |
38 |
50 |
|
[6MA]C:18 |
2 |
1 |
477 |
◊ |
D |
x-1,y,z-1 |
1_454 |
5 |
1 |
18826 |
19.2 |
-0.9 |
0.298 |
0 |
0 |
0 |
0.000 |
39 |
51 |
|
B |
3 |
1 |
2648 |
◊ |
[GOL]B:1012 |
-x,y-1/2,-z |
2_545 |
3 |
1 |
220 |
18.7 |
0.7 |
0.616 |
0 |
0 |
0 |
0.000 |
40 |
52 |
|
E |
2 |
1 |
2653 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
1 |
18826 |
15.7 |
-0.3 |
0.451 |
0 |
0 |
0 |
0.000 |
41 |
53 |
|
B |
3 |
1 |
2648 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
3 |
1 |
2464 |
13.6 |
-1.2 |
0.354 |
0 |
0 |
0 |
0.000 |
42 |
54 |
|
A |
1 |
1 |
18789 |
◊ |
[6MA]F:18 |
x-1,y,z |
1_455 |
3 |
1 |
478 |
13.5 |
-0.4 |
0.421 |
0 |
0 |
0 |
0.000 |
43 |
55 |
|
[6MA]C:18 |
1 |
1 |
477 |
f |
[GOL]B:1012 |
x,y,z |
1_555 |
1 |
1 |
220 |
6.4 |
0.3 |
0.564 |
0 |
0 |
0 |
0.000 |
44 |
56 |
|
D |
1 |
1 |
18826 |
x |
D |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
18826 |
1.4 |
0.0 |
0.595 |
0 |
0 |
0 |
0.000 |
45 |
57 |
|
C |
1 |
1 |
2464 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
1 |
1 |
18789 |
1.0 |
-0.0 |
0.424 |
0 |
0 |
0 |
0.000 |
|