| ## |
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 |
109 |
31 |
7099 |
◊ |
A |
x,y,z |
1_555 |
97 |
25 |
7880 |
897.6 |
-7.8 |
0.534 |
8 |
1 |
0 |
0.222 |
2 |
|
D |
95 |
28 |
7111 |
◊ |
C |
x,y,z |
1_555 |
77 |
20 |
7320 |
778.0 |
-7.7 |
0.453 |
5 |
0 |
0 |
0.222 |
| Average: |
837.8 |
-7.8 |
0.493 |
7 |
1 |
0 |
0.222 |
| 2 |
3 |
|
C |
69 |
20 |
7320 |
◊ |
B |
x,y,z |
1_555 |
64 |
19 |
7099 |
635.2 |
-7.5 |
0.386 |
14 |
0 |
0 |
0.375 |
4 |
|
D |
67 |
19 |
7111 |
◊ |
A |
x,y,z |
1_555 |
69 |
19 |
7880 |
634.2 |
-6.9 |
0.453 |
11 |
0 |
0 |
0.375 |
| Average: |
634.7 |
-7.2 |
0.420 |
13 |
0 |
0 |
0.375 |
| 3 |
5 |
|
B |
33 |
12 |
7099 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
33 |
12 |
7099 |
389.5 |
-7.5 |
0.104 |
2 |
0 |
0 |
0.000 |
| 4 |
6 |
|
D |
27 |
8 |
7111 |
◊ |
D |
-x,-y+1,z |
2_565 |
27 |
8 |
7111 |
294.5 |
-0.1 |
0.742 |
2 |
0 |
0 |
0.000 |
| 5 |
7 |
|
D |
31 |
10 |
7111 |
◊ |
A |
-y,x,z+1/2 |
3_555 |
35 |
9 |
7880 |
270.6 |
-3.9 |
0.405 |
1 |
0 |
0 |
0.000 |
| 6 |
8 |
|
A |
31 |
11 |
7880 |
◊ |
C |
-y,x,z-1/2 |
3_554 |
29 |
9 |
7320 |
250.2 |
-4.8 |
0.298 |
1 |
0 |
0 |
0.000 |
9 |
|
C |
29 |
12 |
7320 |
◊ |
B |
-y+1,x,z+1/2 |
3_655 |
27 |
10 |
7099 |
248.9 |
-3.2 |
0.411 |
2 |
0 |
0 |
0.000 |
| Average: |
249.6 |
-4.0 |
0.355 |
2 |
0 |
0 |
0.000 |
| 7 |
10 |
|
B |
17 |
7 |
7099 |
◊ |
C |
-y+1,x,z-1/2 |
3_654 |
22 |
6 |
7320 |
185.9 |
-4.3 |
0.183 |
0 |
0 |
0 |
0.000 |
| 8 |
11 |
|
C |
25 |
5 |
7320 |
◊ |
A |
x,y,z |
1_555 |
24 |
4 |
7880 |
182.1 |
-4.2 |
0.267 |
0 |
0 |
0 |
0.044 |
| 9 |
12 |
|
B |
20 |
8 |
7099 |
◊ |
D |
-y+1,x,z-1/2 |
3_654 |
18 |
4 |
7111 |
178.3 |
-2.8 |
0.335 |
2 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[MAL]D:339 |
12 |
1 |
474 |
f |
D |
x,y,z |
1_555 |
15 |
9 |
7111 |
139.6 |
2.6 |
0.668 |
2 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[MAL]C:339 |
13 |
1 |
476 |
f |
C |
x,y,z |
1_555 |
15 |
9 |
7320 |
139.5 |
2.7 |
0.628 |
3 |
0 |
0 |
0.000 |
15 |
|
[MAL]A:339 |
12 |
1 |
471 |
f |
A |
x,y,z |
1_555 |
16 |
10 |
7880 |
137.4 |
2.6 |
0.618 |
3 |
0 |
0 |
0.000 |
| Average: |
138.4 |
2.6 |
0.623 |
3 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[MAL]B:339 |
12 |
1 |
468 |
f |
B |
x,y,z |
1_555 |
14 |
10 |
7099 |
126.1 |
2.8 |
0.687 |
3 |
0 |
0 |
0.000 |
| 13 |
17 |
|
[MAL]A:339 |
10 |
1 |
471 |
◊ |
C |
-y,x,z-1/2 |
3_554 |
19 |
5 |
7320 |
103.4 |
0.3 |
0.491 |
1 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[MAL]C:339 |
9 |
1 |
476 |
◊ |
B |
-y+1,x,z+1/2 |
3_655 |
14 |
5 |
7099 |
100.2 |
0.5 |
0.493 |
1 |
0 |
0 |
0.000 |
| 15 |
19 |
|
C |
9 |
4 |
7320 |
◊ |
A |
-y+1,x,z+1/2 |
3_655 |
10 |
4 |
7880 |
97.8 |
-1.7 |
0.323 |
0 |
0 |
0 |
0.000 |
20 |
|
A |
9 |
4 |
7880 |
◊ |
D |
-y,x,z-1/2 |
3_554 |
7 |
3 |
7111 |
84.0 |
-1.7 |
0.226 |
0 |
0 |
0 |
0.000 |
| Average: |
90.9 |
-1.7 |
0.274 |
0 |
0 |
0 |
0.000 |
| 16 |
21 |
|
C |
11 |
3 |
7320 |
◊ |
C |
-x+1,-y+1,z |
2_665 |
10 |
3 |
7320 |
80.8 |
0.4 |
0.752 |
0 |
0 |
0 |
0.000 |
| 17 |
22 |
|
D |
10 |
4 |
7111 |
◊ |
B |
-y,x,z+1/2 |
3_555 |
7 |
3 |
7099 |
77.4 |
-1.4 |
0.285 |
0 |
0 |
0 |
0.000 |
| 18 |
23 |
|
[MAL]B:339 |
9 |
1 |
468 |
◊ |
D |
-y+1,x,z-1/2 |
3_654 |
5 |
2 |
7111 |
43.4 |
0.2 |
0.436 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
[MAL]D:339 |
4 |
1 |
474 |
◊ |
A |
-y,x,z+1/2 |
3_555 |
4 |
2 |
7880 |
42.1 |
0.3 |
0.490 |
0 |
0 |
0 |
0.000 |
| 20 |
25 |
|
[CA]D:1 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
7111 |
32.1 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.472 |
26 |
|
[CA]A:1 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
7880 |
32.1 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.472 |
27 |
|
[CA]B:1 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
7099 |
31.8 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.472 |
28 |
|
[CA]C:1 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
7320 |
30.8 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.472 |
| Average: |
31.7 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.472 |
| 21 |
29 |
|
[MAL]C:339 |
4 |
1 |
476 |
f |
[CA]C:1 |
x,y,z |
1_555 |
1 |
1 |
85 |
26.0 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.229 |
30 |
|
[MAL]B:339 |
4 |
1 |
468 |
f |
[CA]B:1 |
x,y,z |
1_555 |
1 |
1 |
85 |
25.3 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.229 |
31 |
|
[MAL]A:339 |
3 |
1 |
471 |
f |
[CA]A:1 |
x,y,z |
1_555 |
1 |
1 |
85 |
25.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.229 |
32 |
|
[MAL]D:339 |
3 |
1 |
474 |
f |
[CA]D:1 |
x,y,z |
1_555 |
1 |
1 |
85 |
24.4 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.229 |
| Average: |
25.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.229 |
| 22 |
33 |
|
D |
1 |
1 |
7111 |
◊ |
C |
-x,-y,z |
2_555 |
3 |
1 |
7320 |
12.1 |
0.0 |
0.678 |
0 |
0 |
0 |
0.000 |
| 23 |
34 |
|
D |
1 |
1 |
7111 |
◊ |
D |
-x,-y,z |
2_555 |
1 |
1 |
7111 |
8.7 |
0.3 |
0.845 |
0 |
0 |
0 |
0.000 |
35 |
|
A |
2 |
2 |
7880 |
◊ |
A |
-x,-y+1,z |
2_565 |
2 |
2 |
7880 |
7.4 |
0.2 |
0.737 |
0 |
0 |
0 |
0.000 |
| Average: |
8.1 |
0.2 |
0.791 |
0 |
0 |
0 |
0.000 |
| 24 |
36 |
|
B |
1 |
1 |
7099 |
◊ |
A |
-x+1,-y,z |
2_655 |
2 |
2 |
7880 |
3.5 |
0.0 |
0.701 |
0 |
0 |
0 |
0.000 |
| 25 |
37 |
|
A |
1 |
1 |
7880 |
◊ |
A |
-x+1,-y,z |
2_655 |
1 |
1 |
7880 |
3.0 |
-0.1 |
0.449 |
0 |
0 |
0 |
0.000 |
|