| ## |
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 |
|
I |
218 |
55 |
15089 |
◊ |
A |
x,y,z |
1_555 |
215 |
55 |
14891 |
1967.1 |
-25.4 |
0.049 |
22 |
13 |
0 |
0.779 |
2 |
|
E |
215 |
55 |
14774 |
◊ |
B |
x,y,z |
1_555 |
219 |
55 |
15123 |
1966.9 |
-25.9 |
0.047 |
22 |
14 |
0 |
0.779 |
3 |
|
K |
187 |
45 |
14349 |
◊ |
D |
x,y,z |
1_555 |
190 |
44 |
14551 |
1699.2 |
-23.2 |
0.035 |
19 |
14 |
0 |
0.779 |
4 |
|
H |
186 |
44 |
14386 |
◊ |
F |
x,y,z |
1_555 |
188 |
44 |
14304 |
1691.9 |
-23.4 |
0.033 |
16 |
14 |
0 |
0.779 |
5 |
|
L |
187 |
44 |
14236 |
◊ |
G |
x,y,z |
1_555 |
186 |
44 |
14436 |
1689.1 |
-23.2 |
0.031 |
15 |
14 |
0 |
0.779 |
6 |
|
J |
186 |
44 |
14366 |
◊ |
C |
x,y,z |
1_555 |
187 |
44 |
14762 |
1685.0 |
-22.1 |
0.042 |
18 |
14 |
0 |
0.779 |
| Average: |
1783.2 |
-23.9 |
0.040 |
19 |
14 |
0 |
0.779 |
| 2 |
7 |
|
E |
88 |
25 |
14774 |
◊ |
I |
x-1,y,z |
1_455 |
85 |
25 |
15089 |
800.0 |
-5.2 |
0.436 |
10 |
1 |
0 |
0.000 |
8 |
|
B |
85 |
25 |
15123 |
◊ |
A |
x,y,z |
1_555 |
86 |
25 |
14891 |
789.0 |
-4.2 |
0.483 |
9 |
0 |
0 |
0.000 |
| Average: |
794.5 |
-4.7 |
0.459 |
10 |
1 |
0 |
0.000 |
| 3 |
9 |
|
F |
74 |
19 |
14304 |
◊ |
C |
x,y,z |
1_555 |
59 |
18 |
14762 |
561.1 |
1.2 |
0.726 |
5 |
1 |
0 |
0.017 |
10 |
|
D |
57 |
16 |
14551 |
◊ |
L |
-x+2,y-1/2,-z+1 |
2_746 |
69 |
19 |
14236 |
551.4 |
1.3 |
0.739 |
6 |
1 |
0 |
0.017 |
| Average: |
556.2 |
1.2 |
0.732 |
6 |
1 |
0 |
0.017 |
| 4 |
11 |
|
D |
53 |
19 |
14551 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
43 |
12 |
14436 |
441.8 |
1.4 |
0.768 |
6 |
4 |
0 |
0.000 |
12 |
|
H |
43 |
12 |
14386 |
◊ |
C |
x-1,y,z |
1_455 |
52 |
19 |
14762 |
419.7 |
0.6 |
0.689 |
6 |
3 |
0 |
0.000 |
| Average: |
430.7 |
1.0 |
0.728 |
6 |
4 |
0 |
0.000 |
| 5 |
13 |
|
C |
51 |
18 |
14762 |
◊ |
B |
x,y,z |
1_555 |
51 |
14 |
15123 |
419.1 |
2.1 |
0.822 |
3 |
4 |
0 |
0.000 |
14 |
|
D |
43 |
16 |
14551 |
◊ |
I |
-x+2,y-1/2,-z+1 |
2_746 |
43 |
12 |
15089 |
347.0 |
0.9 |
0.741 |
3 |
4 |
0 |
0.000 |
| Average: |
383.1 |
1.5 |
0.782 |
3 |
4 |
0 |
0.000 |
| 6 |
15 |
|
J |
44 |
11 |
14366 |
◊ |
G |
x,y,z-1 |
1_554 |
39 |
10 |
14436 |
356.1 |
1.1 |
0.763 |
5 |
4 |
0 |
0.000 |
16 |
|
K |
43 |
12 |
14349 |
◊ |
H |
-x+1,y-1/2,-z |
2_645 |
42 |
11 |
14386 |
338.3 |
0.9 |
0.762 |
3 |
2 |
0 |
0.000 |
| Average: |
347.2 |
1.0 |
0.763 |
4 |
3 |
0 |
0.000 |
| 7 |
17 |
|
[CSC]J:1385 |
24 |
1 |
540 |
f |
J |
x,y,z |
1_555 |
50 |
18 |
14366 |
355.6 |
-0.0 |
0.422 |
12 |
0 |
0 |
0.261 |
18 |
|
[CSC]B:1384 |
24 |
1 |
533 |
f |
B |
x,y,z |
1_555 |
49 |
18 |
15123 |
347.8 |
0.6 |
0.443 |
8 |
0 |
0 |
0.261 |
19 |
|
[CSC]C:1383 |
25 |
1 |
531 |
f |
C |
x,y,z |
1_555 |
45 |
18 |
14762 |
346.7 |
0.4 |
0.421 |
13 |
0 |
0 |
0.261 |
20 |
|
[CSC]L:1383 |
25 |
1 |
536 |
f |
L |
x,y,z |
1_555 |
47 |
18 |
14236 |
346.5 |
0.6 |
0.442 |
14 |
0 |
0 |
0.261 |
21 |
|
[CSC]E:1383 |
25 |
1 |
549 |
f |
E |
x,y,z |
1_555 |
44 |
18 |
14774 |
345.8 |
0.4 |
0.505 |
12 |
0 |
0 |
0.261 |
22 |
|
[CSC]F:1384 |
25 |
1 |
531 |
f |
F |
x,y,z |
1_555 |
47 |
18 |
14304 |
343.9 |
0.3 |
0.446 |
13 |
0 |
0 |
0.261 |
23 |
|
[CSC]I:1384 |
24 |
1 |
524 |
f |
I |
x,y,z |
1_555 |
49 |
18 |
15089 |
341.9 |
0.8 |
0.434 |
13 |
0 |
0 |
0.261 |
24 |
|
[CSC]K:1385 |
24 |
1 |
536 |
f |
K |
x,y,z |
1_555 |
49 |
18 |
14349 |
341.0 |
-0.1 |
0.464 |
13 |
0 |
0 |
0.261 |
25 |
|
[CSC]H:1383 |
25 |
1 |
538 |
f |
H |
x,y,z |
1_555 |
45 |
18 |
14386 |
338.9 |
0.6 |
0.488 |
12 |
0 |
0 |
0.261 |
26 |
|
[CSC]A:1383 |
25 |
1 |
542 |
f |
A |
x,y,z |
1_555 |
47 |
18 |
14891 |
335.5 |
0.1 |
0.496 |
12 |
0 |
0 |
0.261 |
27 |
|
[CSC]G:1383 |
25 |
1 |
544 |
f |
G |
x,y,z |
1_555 |
45 |
18 |
14436 |
330.0 |
-0.5 |
0.398 |
10 |
0 |
0 |
0.261 |
28 |
|
[CSC]D:1383 |
24 |
1 |
525 |
f |
D |
x,y,z |
1_555 |
46 |
18 |
14551 |
325.0 |
0.1 |
0.454 |
14 |
0 |
0 |
0.261 |
| Average: |
341.6 |
0.3 |
0.451 |
12 |
0 |
0 |
0.261 |
| 8 |
29 |
|
I |
39 |
10 |
15089 |
◊ |
D |
x,y,z |
1_555 |
41 |
14 |
14551 |
348.1 |
0.8 |
0.708 |
6 |
0 |
0 |
0.000 |
30 |
|
C |
40 |
13 |
14762 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
39 |
10 |
15123 |
341.1 |
-0.4 |
0.633 |
7 |
0 |
0 |
0.000 |
| Average: |
344.6 |
0.2 |
0.671 |
7 |
0 |
0 |
0.000 |
| 9 |
31 |
|
F |
35 |
9 |
14304 |
◊ |
H |
-x,y-1/2,-z |
2_545 |
28 |
9 |
14386 |
337.9 |
-1.4 |
0.450 |
4 |
0 |
0 |
0.000 |
32 |
|
G |
28 |
9 |
14436 |
◊ |
L |
-x+1,y-1/2,-z+1 |
2_646 |
33 |
9 |
14236 |
333.6 |
-2.2 |
0.391 |
4 |
1 |
0 |
0.000 |
| Average: |
335.8 |
-1.8 |
0.420 |
4 |
1 |
0 |
0.000 |
| 10 |
33 |
|
D |
36 |
10 |
14551 |
◊ |
E |
-x+1,y-1/2,-z+1 |
2_646 |
33 |
9 |
14774 |
292.3 |
-0.9 |
0.578 |
0 |
1 |
0 |
0.011 |
34 |
|
C |
34 |
10 |
14762 |
◊ |
A |
x,y,z |
1_555 |
32 |
9 |
14891 |
285.2 |
-0.1 |
0.658 |
0 |
0 |
0 |
0.011 |
| Average: |
288.8 |
-0.5 |
0.618 |
0 |
1 |
0 |
0.011 |
| 11 |
35 |
|
K |
34 |
11 |
14349 |
◊ |
A |
x,y,z |
1_555 |
36 |
11 |
14891 |
284.1 |
-0.6 |
0.605 |
5 |
0 |
0 |
0.000 |
36 |
|
J |
32 |
10 |
14366 |
◊ |
E |
-x+1,y-1/2,-z |
2_645 |
36 |
11 |
14774 |
275.3 |
-0.1 |
0.687 |
5 |
0 |
0 |
0.000 |
| Average: |
279.7 |
-0.4 |
0.646 |
5 |
0 |
0 |
0.000 |
| 12 |
37 |
|
G |
32 |
12 |
14436 |
◊ |
E |
x,y,z |
1_555 |
30 |
10 |
14774 |
232.6 |
-0.6 |
0.555 |
0 |
0 |
0 |
0.000 |
38 |
|
H |
32 |
12 |
14386 |
◊ |
A |
x-1,y,z |
1_455 |
30 |
10 |
14891 |
230.9 |
-0.6 |
0.555 |
0 |
0 |
0 |
0.000 |
| Average: |
231.7 |
-0.6 |
0.555 |
0 |
0 |
0 |
0.000 |
| 13 |
39 |
|
L |
29 |
9 |
14236 |
◊ |
I |
x,y,z |
1_555 |
32 |
10 |
15089 |
226.4 |
0.6 |
0.715 |
4 |
0 |
0 |
0.000 |
40 |
|
F |
29 |
9 |
14304 |
◊ |
B |
x,y,z |
1_555 |
33 |
10 |
15123 |
226.1 |
0.5 |
0.712 |
4 |
0 |
0 |
0.000 |
| Average: |
226.2 |
0.5 |
0.713 |
4 |
0 |
0 |
0.000 |
| 14 |
41 |
|
K |
24 |
8 |
14349 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
23 |
6 |
14436 |
202.4 |
-1.5 |
0.301 |
1 |
2 |
0 |
0.000 |
42 |
|
H |
22 |
6 |
14386 |
◊ |
J |
x-1,y,z |
1_455 |
23 |
8 |
14366 |
197.6 |
-1.7 |
0.283 |
1 |
1 |
0 |
0.000 |
| Average: |
200.0 |
-1.6 |
0.292 |
1 |
2 |
0 |
0.000 |
| 15 |
43 |
|
[ACT]G:1384 |
4 |
1 |
183 |
f |
G |
x,y,z |
1_555 |
19 |
7 |
14436 |
115.4 |
-0.1 |
0.709 |
1 |
0 |
0 |
0.012 |
| 16 |
44 |
|
[ACT]L:1384 |
4 |
1 |
183 |
f |
L |
x,y,z |
1_555 |
21 |
7 |
14236 |
113.5 |
-0.2 |
0.708 |
0 |
0 |
0 |
0.005 |
45 |
|
[ACT]F:1385 |
4 |
1 |
183 |
f |
F |
x,y,z |
1_555 |
22 |
7 |
14304 |
113.0 |
0.5 |
0.765 |
0 |
0 |
0 |
0.005 |
| Average: |
113.3 |
0.2 |
0.737 |
0 |
0 |
0 |
0.005 |
| 17 |
46 |
|
[ACT]H:1384 |
4 |
1 |
182 |
f |
H |
x,y,z |
1_555 |
21 |
7 |
14386 |
111.8 |
-0.5 |
0.636 |
0 |
0 |
0 |
0.012 |
| 18 |
47 |
|
J |
14 |
6 |
14366 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
12 |
4 |
15123 |
105.8 |
0.5 |
0.715 |
0 |
0 |
0 |
0.000 |
48 |
|
K |
14 |
6 |
14349 |
◊ |
I |
x,y,z |
1_555 |
10 |
4 |
15089 |
104.8 |
0.2 |
0.682 |
0 |
0 |
0 |
0.000 |
| Average: |
105.3 |
0.3 |
0.698 |
0 |
0 |
0 |
0.000 |
| 19 |
49 |
|
[ACT]C:1384 |
4 |
1 |
181 |
◊ |
C |
x,y,z |
1_555 |
18 |
7 |
14762 |
105.5 |
-0.2 |
0.685 |
1 |
0 |
0 |
0.008 |
50 |
|
[ACT]D:1384 |
4 |
1 |
181 |
◊ |
D |
x,y,z |
1_555 |
18 |
7 |
14551 |
104.3 |
-0.3 |
0.681 |
1 |
0 |
0 |
0.008 |
| Average: |
104.9 |
-0.3 |
0.683 |
1 |
0 |
0 |
0.008 |
| 20 |
51 |
|
[ACT]I:1385 |
4 |
1 |
183 |
◊ |
I |
x,y,z |
1_555 |
22 |
7 |
15089 |
99.6 |
-0.6 |
0.648 |
0 |
0 |
0 |
0.000 |
| 21 |
52 |
|
[ACT]B:1385 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
21 |
7 |
15123 |
99.4 |
-0.6 |
0.645 |
0 |
0 |
0 |
0.000 |
| 22 |
53 |
|
[ACT]A:1384 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
14891 |
97.8 |
-0.7 |
0.654 |
0 |
0 |
0 |
0.000 |
| 23 |
54 |
|
[ACT]E:1384 |
4 |
1 |
182 |
◊ |
E |
x,y,z |
1_555 |
22 |
7 |
14774 |
97.1 |
-0.6 |
0.658 |
0 |
0 |
0 |
0.000 |
| 24 |
55 |
|
J |
7 |
3 |
14366 |
◊ |
L |
x,y,z-1 |
1_554 |
15 |
4 |
14236 |
86.0 |
0.3 |
0.622 |
1 |
1 |
0 |
0.000 |
56 |
|
K |
6 |
3 |
14349 |
◊ |
F |
-x+1,y-1/2,-z |
2_645 |
14 |
4 |
14304 |
81.1 |
0.3 |
0.626 |
1 |
1 |
0 |
0.000 |
| Average: |
83.5 |
0.3 |
0.624 |
1 |
1 |
0 |
0.000 |
| 25 |
57 |
|
[ACT]E:1384 |
3 |
1 |
182 |
f |
I |
x-1,y,z |
1_455 |
6 |
3 |
15089 |
48.4 |
-0.9 |
0.441 |
0 |
0 |
0 |
0.017 |
| 26 |
58 |
|
[ACT]B:1385 |
3 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
14891 |
46.8 |
-0.8 |
0.465 |
0 |
0 |
0 |
0.015 |
| 27 |
59 |
|
E |
5 |
3 |
14774 |
f |
[ACT]I:1385 |
x-1,y,z |
1_455 |
3 |
1 |
183 |
46.7 |
-0.8 |
0.446 |
0 |
0 |
0 |
0.017 |
| 28 |
60 |
|
[ACT]A:1384 |
3 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
15123 |
46.0 |
-0.6 |
0.455 |
1 |
0 |
0 |
0.027 |
| 29 |
61 |
|
[ACT]D:1384 |
1 |
1 |
181 |
f |
E |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
14774 |
32.4 |
-1.0 |
0.156 |
0 |
0 |
0 |
0.021 |
62 |
|
[ACT]C:1384 |
1 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
14891 |
31.5 |
-1.0 |
0.158 |
0 |
0 |
0 |
0.021 |
| Average: |
32.0 |
-1.0 |
0.157 |
0 |
0 |
0 |
0.021 |
| 30 |
63 |
|
F |
1 |
1 |
14304 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
2 |
1 |
14762 |
8.5 |
0.1 |
0.733 |
0 |
0 |
0 |
0.000 |
64 |
|
D |
1 |
1 |
14551 |
◊ |
L |
x,y-1,z |
1_545 |
1 |
1 |
14236 |
5.1 |
0.1 |
0.791 |
0 |
0 |
0 |
0.000 |
| Average: |
6.8 |
0.1 |
0.762 |
0 |
0 |
0 |
0.000 |
| 31 |
65 |
|
[CSC]D:1383 |
1 |
1 |
525 |
◊ |
L |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
14236 |
2.1 |
-0.1 |
0.397 |
0 |
0 |
0 |
0.000 |
|