| ## |
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 |
263 |
70 |
12616 |
◊ |
A |
x,y,z |
1_555 |
264 |
70 |
12324 |
2545.3 |
-42.1 |
0.031 |
21 |
12 |
0 |
1.000 |
| 2 |
2 |
|
D |
99 |
18 |
4867 |
◊ |
C |
x,y,z |
1_555 |
98 |
18 |
4868 |
915.1 |
2.8 |
0.756 |
46 |
0 |
0 |
0.232 |
| 3 |
3 |
|
D |
33 |
5 |
4867 |
◊ |
B |
x,y,z |
1_555 |
57 |
18 |
12616 |
356.7 |
-1.8 |
0.597 |
7 |
0 |
0 |
0.143 |
4 |
|
C |
26 |
4 |
4868 |
◊ |
A |
x,y,z |
1_555 |
39 |
15 |
12324 |
264.5 |
-2.8 |
0.480 |
7 |
0 |
0 |
0.143 |
| Average: |
310.6 |
-2.3 |
0.539 |
7 |
0 |
0 |
0.143 |
| 4 |
5 |
|
C |
36 |
7 |
4868 |
◊ |
B |
x,y,z |
1_555 |
42 |
14 |
12616 |
353.6 |
-0.9 |
0.370 |
1 |
0 |
0 |
0.027 |
6 |
|
D |
23 |
5 |
4867 |
◊ |
A |
x,y,z |
1_555 |
27 |
10 |
12324 |
217.4 |
-0.7 |
0.576 |
0 |
0 |
0 |
0.027 |
| Average: |
285.5 |
-0.8 |
0.473 |
1 |
0 |
0 |
0.027 |
| 5 |
7 |
|
B |
28 |
11 |
12616 |
◊ |
A |
-x,-x+y,-z+1/3 |
6_555 |
27 |
9 |
12324 |
248.0 |
-1.4 |
0.610 |
2 |
3 |
0 |
0.000 |
| 6 |
8 |
|
[BRU]C:6 |
19 |
1 |
468 |
cf |
C |
x,y,z |
1_555 |
29 |
2 |
4868 |
222.3 |
2.6 |
0.682 |
0 |
0 |
0 |
0.000 |
9 |
|
[BRU]D:6 |
20 |
1 |
461 |
cf |
D |
x,y,z |
1_555 |
31 |
2 |
4867 |
221.3 |
3.1 |
0.704 |
2 |
0 |
0 |
0.000 |
| Average: |
221.8 |
2.8 |
0.693 |
1 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[BRU]C:4 |
17 |
1 |
440 |
cf |
C |
x,y,z |
1_555 |
26 |
2 |
4868 |
200.0 |
2.3 |
0.645 |
0 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[BRU]D:4 |
17 |
1 |
439 |
cf |
D |
x,y,z |
1_555 |
28 |
2 |
4867 |
190.1 |
2.1 |
0.645 |
0 |
0 |
0 |
0.000 |
| 9 |
12 |
|
C |
24 |
5 |
4868 |
◊ |
B |
-x+1,-x+y,-z+1/3 |
6_655 |
22 |
5 |
12616 |
182.1 |
-1.2 |
0.577 |
4 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[BRU]D:4 |
18 |
1 |
439 |
◊ |
B |
x,y,z |
1_555 |
37 |
12 |
12616 |
170.0 |
-0.7 |
0.521 |
2 |
0 |
0 |
0.040 |
14 |
|
[BRU]C:4 |
15 |
1 |
440 |
◊ |
A |
x,y,z |
1_555 |
28 |
9 |
12324 |
146.9 |
-0.6 |
0.502 |
2 |
0 |
0 |
0.040 |
| Average: |
158.4 |
-0.6 |
0.512 |
2 |
0 |
0 |
0.040 |
| 11 |
15 |
|
D |
15 |
3 |
4867 |
◊ |
B |
-x+1,-x+y,-z+1/3 |
6_655 |
18 |
6 |
12616 |
158.7 |
1.6 |
0.722 |
2 |
0 |
0 |
0.000 |
| 12 |
16 |
|
A |
16 |
6 |
12324 |
◊ |
D |
y,x-1,-z |
4_545 |
23 |
6 |
4867 |
158.6 |
0.8 |
0.688 |
4 |
0 |
0 |
0.000 |
| 13 |
17 |
|
A |
18 |
6 |
12324 |
◊ |
C |
y,x-1,-z |
4_545 |
14 |
3 |
4868 |
155.1 |
1.0 |
0.652 |
3 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[BRU]C:6 |
11 |
1 |
468 |
◊ |
A |
x,y,z |
1_555 |
23 |
6 |
12324 |
136.7 |
-1.7 |
0.462 |
0 |
0 |
0 |
0.022 |
| 15 |
19 |
|
[BRU]C:14 |
11 |
1 |
456 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
12616 |
130.6 |
-1.4 |
0.425 |
2 |
0 |
0 |
0.062 |
20 |
|
[BRU]D:14 |
12 |
1 |
450 |
◊ |
A |
x,y,z |
1_555 |
18 |
6 |
12324 |
123.5 |
-1.6 |
0.421 |
2 |
0 |
0 |
0.062 |
| Average: |
127.1 |
-1.5 |
0.423 |
2 |
0 |
0 |
0.062 |
| 16 |
21 |
|
[BRU]D:6 |
11 |
1 |
461 |
◊ |
B |
x,y,z |
1_555 |
23 |
7 |
12616 |
126.2 |
-1.2 |
0.490 |
0 |
0 |
0 |
0.016 |
| 17 |
22 |
|
[BRU]C:15 |
11 |
1 |
457 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
12616 |
125.9 |
-2.2 |
0.353 |
0 |
0 |
0 |
0.065 |
23 |
|
[BRU]D:15 |
10 |
1 |
461 |
◊ |
A |
x,y,z |
1_555 |
21 |
4 |
12324 |
123.4 |
-2.3 |
0.358 |
1 |
0 |
0 |
0.065 |
| Average: |
124.7 |
-2.2 |
0.356 |
1 |
0 |
0 |
0.065 |
| 18 |
24 |
|
[BRU]C:14 |
14 |
1 |
456 |
cf |
C |
x,y,z |
1_555 |
15 |
1 |
4868 |
122.8 |
2.6 |
0.667 |
1 |
0 |
0 |
0.000 |
25 |
|
[BRU]D:14 |
14 |
1 |
450 |
cf |
D |
x,y,z |
1_555 |
16 |
1 |
4867 |
119.8 |
2.4 |
0.648 |
2 |
0 |
0 |
0.000 |
| Average: |
121.3 |
2.5 |
0.658 |
2 |
0 |
0 |
0.000 |
| 19 |
26 |
|
[BRU]D:15 |
14 |
1 |
461 |
cf |
D |
x,y,z |
1_555 |
14 |
2 |
4867 |
117.2 |
2.9 |
0.677 |
0 |
0 |
0 |
0.000 |
27 |
|
[BRU]C:15 |
14 |
1 |
457 |
cf |
C |
x,y,z |
1_555 |
12 |
1 |
4868 |
116.1 |
2.7 |
0.704 |
0 |
0 |
0 |
0.000 |
| Average: |
116.6 |
2.8 |
0.691 |
0 |
0 |
0 |
0.000 |
| 20 |
28 |
|
[BRU]D:15 |
13 |
1 |
461 |
cf |
[BRU]D:14 |
x,y,z |
1_555 |
13 |
1 |
450 |
116.6 |
2.3 |
0.601 |
0 |
0 |
0 |
0.000 |
29 |
|
[BRU]C:15 |
14 |
1 |
457 |
cf |
[BRU]C:14 |
x,y,z |
1_555 |
12 |
1 |
456 |
114.1 |
2.2 |
0.635 |
0 |
0 |
0 |
0.000 |
| Average: |
115.4 |
2.2 |
0.618 |
0 |
0 |
0 |
0.000 |
| 21 |
30 |
|
B |
8 |
3 |
12616 |
◊ |
C |
y,x-1,-z |
4_545 |
12 |
1 |
4868 |
78.1 |
1.0 |
0.560 |
0 |
0 |
0 |
0.000 |
| 22 |
31 |
|
A |
12 |
3 |
12324 |
◊ |
D |
x-1,y,z |
1_455 |
9 |
3 |
4867 |
77.5 |
-2.2 |
0.382 |
1 |
0 |
0 |
0.000 |
| 23 |
32 |
|
D |
12 |
1 |
4867 |
◊ |
A |
-x+1,-x+y,-z+1/3 |
6_655 |
7 |
3 |
12324 |
76.2 |
0.4 |
0.495 |
0 |
0 |
0 |
0.000 |
| 24 |
33 |
|
[BRU]D:4 |
9 |
1 |
439 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
4868 |
70.6 |
1.4 |
0.581 |
3 |
0 |
0 |
0.000 |
34 |
|
[BRU]C:4 |
7 |
1 |
440 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
4867 |
68.8 |
1.4 |
0.593 |
3 |
0 |
0 |
0.000 |
| Average: |
69.7 |
1.4 |
0.587 |
3 |
0 |
0 |
0.000 |
| 25 |
35 |
|
[BRU]D:15 |
7 |
1 |
461 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
4868 |
68.9 |
1.0 |
0.568 |
1 |
0 |
0 |
0.000 |
36 |
|
[BRU]C:15 |
7 |
1 |
457 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
4867 |
68.5 |
0.7 |
0.566 |
1 |
0 |
0 |
0.000 |
| Average: |
68.7 |
0.8 |
0.567 |
1 |
0 |
0 |
0.000 |
| 26 |
37 |
|
[BRU]D:6 |
7 |
1 |
461 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
4868 |
64.1 |
1.1 |
0.584 |
2 |
0 |
0 |
0.000 |
| 27 |
38 |
|
[BRU]C:14 |
6 |
1 |
456 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
4867 |
63.8 |
0.5 |
0.540 |
2 |
0 |
0 |
0.009 |
39 |
|
[BRU]D:14 |
6 |
1 |
450 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
4868 |
62.8 |
0.6 |
0.536 |
2 |
0 |
0 |
0.009 |
| Average: |
63.3 |
0.6 |
0.538 |
2 |
0 |
0 |
0.009 |
| 28 |
40 |
|
[BRU]C:6 |
6 |
1 |
468 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
4867 |
60.0 |
1.0 |
0.583 |
2 |
0 |
0 |
0.000 |
| 29 |
41 |
|
A |
3 |
1 |
12324 |
◊ |
C |
x-1,y,z |
1_455 |
7 |
3 |
4868 |
36.5 |
1.2 |
0.748 |
0 |
0 |
0 |
0.000 |
| 30 |
42 |
|
A |
1 |
1 |
12324 |
x |
A |
x-1,y-1,z |
1_445 |
4 |
1 |
12324 |
31.7 |
0.2 |
0.694 |
0 |
0 |
0 |
0.000 |
| 31 |
43 |
|
B |
3 |
1 |
12616 |
◊ |
D |
y,x-1,-z |
4_545 |
7 |
1 |
4867 |
27.5 |
-0.5 |
0.355 |
0 |
0 |
0 |
0.000 |
| 32 |
44 |
|
C |
5 |
1 |
4868 |
◊ |
A |
-x+1,-x+y,-z+1/3 |
6_655 |
2 |
1 |
12324 |
22.9 |
-0.6 |
0.331 |
0 |
0 |
0 |
0.000 |
| 33 |
45 |
|
B |
1 |
1 |
12616 |
x |
B |
x,y-1,z |
1_545 |
2 |
1 |
12616 |
4.4 |
0.2 |
0.743 |
0 |
0 |
0 |
0.000 |
| 34 |
46 |
|
B |
1 |
1 |
12616 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
4868 |
0.2 |
-0.0 |
0.453 |
0 |
0 |
0 |
0.000 |
| 35 |
47 |
|
[BRU]C:6 |
1 |
1 |
468 |
f |
[BRU]C:4 |
x,y,z |
1_555 |
1 |
1 |
440 |
0.1 |
0.0 |
0.332 |
0 |
0 |
0 |
0.000 |
|