| ## |
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 |
|
F |
55 |
12 |
2823 |
◊ |
E |
x,y,z |
1_555 |
53 |
12 |
2816 |
545.7 |
-8.3 |
0.551 |
35 |
0 |
0 |
1.000 |
2 |
|
D |
56 |
12 |
2807 |
◊ |
C |
x,y,z |
1_555 |
53 |
12 |
2807 |
543.9 |
-8.6 |
0.541 |
36 |
0 |
0 |
1.000 |
| Average: |
544.8 |
-8.4 |
0.546 |
36 |
0 |
0 |
1.000 |
| 2 |
3 |
|
C |
49 |
6 |
2807 |
◊ |
A |
x,y,z |
1_555 |
56 |
17 |
4231 |
464.5 |
-6.5 |
0.454 |
6 |
0 |
0 |
0.224 |
4 |
|
E |
38 |
6 |
2816 |
◊ |
B |
x,y,z |
1_555 |
48 |
15 |
3825 |
399.5 |
-7.3 |
0.359 |
7 |
0 |
0 |
0.224 |
| Average: |
432.0 |
-6.9 |
0.407 |
7 |
0 |
0 |
0.224 |
| 3 |
5 |
|
D |
50 |
9 |
2807 |
◊ |
A |
x,y,z |
1_555 |
38 |
9 |
4231 |
382.3 |
2.8 |
0.842 |
7 |
0 |
0 |
0.004 |
6 |
|
F |
30 |
7 |
2823 |
◊ |
B |
x,y,z |
1_555 |
24 |
5 |
3825 |
250.2 |
2.0 |
0.824 |
3 |
0 |
0 |
0.004 |
| Average: |
316.2 |
2.4 |
0.833 |
5 |
0 |
0 |
0.004 |
| 4 |
7 |
|
B |
46 |
9 |
3825 |
◊ |
A |
x,y,z |
1_555 |
41 |
13 |
4231 |
355.9 |
-2.9 |
0.350 |
0 |
0 |
0 |
0.004 |
| 5 |
8 |
|
A |
29 |
9 |
4231 |
x |
A |
x,y-1,z |
1_545 |
31 |
9 |
4231 |
260.1 |
-0.8 |
0.502 |
3 |
0 |
0 |
0.000 |
9 |
|
B |
23 |
8 |
3825 |
x |
B |
x,y-1,z |
1_545 |
24 |
8 |
3825 |
199.7 |
-1.8 |
0.434 |
3 |
0 |
0 |
0.000 |
| Average: |
229.9 |
-1.3 |
0.468 |
3 |
0 |
0 |
0.000 |
| 6 |
10 |
|
F |
20 |
2 |
2823 |
◊ |
D |
-x,y-1,-z |
2_545 |
15 |
2 |
2807 |
142.9 |
2.4 |
0.812 |
0 |
0 |
0 |
0.000 |
11 |
|
D |
19 |
2 |
2807 |
◊ |
F |
-x-1/2,y-1/2,-z |
4_445 |
15 |
2 |
2823 |
139.8 |
3.0 |
0.837 |
0 |
0 |
0 |
0.000 |
12 |
|
E |
15 |
2 |
2816 |
◊ |
C |
-x,y-1,-z |
2_545 |
19 |
2 |
2807 |
139.4 |
2.9 |
0.837 |
0 |
0 |
0 |
0.000 |
13 |
|
C |
14 |
2 |
2807 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
18 |
2 |
2816 |
136.9 |
3.5 |
0.857 |
0 |
0 |
0 |
0.000 |
| Average: |
139.7 |
3.0 |
0.836 |
0 |
0 |
0 |
0.000 |
| 7 |
14 |
|
F |
11 |
3 |
2823 |
◊ |
B |
x,y-1,z |
1_545 |
11 |
6 |
3825 |
90.1 |
0.8 |
0.705 |
0 |
0 |
0 |
0.000 |
15 |
|
D |
12 |
3 |
2807 |
◊ |
A |
x,y-1,z |
1_545 |
12 |
6 |
4231 |
88.1 |
1.1 |
0.711 |
0 |
0 |
0 |
0.000 |
| Average: |
89.1 |
0.9 |
0.708 |
0 |
0 |
0 |
0.000 |
| 8 |
16 |
|
E |
11 |
4 |
2816 |
◊ |
B |
x,y-1,z |
1_545 |
14 |
5 |
3825 |
83.2 |
-1.8 |
0.468 |
0 |
0 |
0 |
0.000 |
17 |
|
C |
6 |
3 |
2807 |
◊ |
A |
x,y-1,z |
1_545 |
11 |
5 |
4231 |
59.4 |
-1.6 |
0.393 |
0 |
0 |
0 |
0.000 |
| Average: |
71.3 |
-1.7 |
0.431 |
0 |
0 |
0 |
0.000 |
| 9 |
18 |
|
D |
10 |
2 |
2807 |
◊ |
D |
-x,y,-z+1 |
2_556 |
10 |
2 |
2807 |
75.4 |
-1.7 |
0.476 |
0 |
0 |
0 |
0.000 |
| 10 |
19 |
|
A |
11 |
5 |
4231 |
◊ |
A |
-x,y,-z |
2_555 |
11 |
5 |
4231 |
74.8 |
-0.4 |
0.518 |
0 |
0 |
0 |
0.000 |
| 11 |
20 |
|
[UNX]B:1003 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
3825 |
68.8 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.158 |
21 |
|
[UNX]A:1004 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
4231 |
68.1 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.158 |
| Average: |
68.4 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.158 |
| 12 |
22 |
|
[UNX]B:1010 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
3825 |
64.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.078 |
| 13 |
23 |
|
[UNX]D:101 |
1 |
1 |
129 |
f |
D |
x,y,z |
1_555 |
11 |
3 |
2807 |
62.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.153 |
24 |
|
[UNX]A:1006 |
1 |
1 |
129 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
2807 |
38.0 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.153 |
| Average: |
50.2 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.153 |
| 14 |
25 |
|
[UNX]A:1008 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
4231 |
60.0 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.106 |
| 15 |
26 |
|
[UNX]A:1005 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
4231 |
58.5 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.104 |
27 |
|
[UNX]B:1008 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
3825 |
55.1 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.104 |
| Average: |
56.8 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.104 |
| 16 |
28 |
|
[UNX]B:1009 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
3825 |
56.8 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.065 |
29 |
|
[UNX]A:1003 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
4231 |
54.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.065 |
| Average: |
55.4 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.065 |
| 17 |
30 |
|
E |
7 |
2 |
2816 |
x |
E |
-x-1/2,y-1/2,-z-1 |
4_444 |
5 |
1 |
2816 |
56.6 |
-1.1 |
0.446 |
0 |
0 |
0 |
0.000 |
| 18 |
31 |
|
[UNX]B:1005 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
3825 |
55.1 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.118 |
32 |
|
[UNX]A:1007 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
4231 |
53.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.118 |
33 |
|
[UNX]B:1006 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
3825 |
44.5 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.118 |
| Average: |
51.2 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.118 |
| 19 |
34 |
|
[UNX]B:1004 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
3825 |
50.3 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.061 |
| 20 |
35 |
|
[UNX]A:1006 |
1 |
1 |
129 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
2807 |
48.6 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.115 |
36 |
|
[UNX]D:101 |
1 |
1 |
129 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
2807 |
29.8 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.115 |
| Average: |
39.2 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.115 |
| 21 |
37 |
|
[UNX]B:1004 |
1 |
1 |
129 |
◊ |
F |
x,y,z |
1_555 |
8 |
3 |
2823 |
47.4 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.031 |
| 22 |
38 |
|
[UNX]B:1007 |
1 |
1 |
129 |
◊ |
A |
x,y,z |
1_555 |
7 |
5 |
4231 |
43.8 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.004 |
| 23 |
39 |
|
[UNX]B:1007 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
3825 |
42.7 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.054 |
| 24 |
40 |
|
F |
5 |
1 |
2823 |
◊ |
C |
-x,y-1,-z |
2_545 |
5 |
1 |
2807 |
41.7 |
-0.2 |
0.542 |
0 |
0 |
0 |
0.000 |
41 |
|
D |
5 |
1 |
2807 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
5 |
1 |
2816 |
39.0 |
-0.2 |
0.537 |
0 |
0 |
0 |
0.000 |
| Average: |
40.4 |
-0.2 |
0.539 |
0 |
0 |
0 |
0.000 |
| 25 |
42 |
|
[UNX]C:101 |
1 |
1 |
129 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
2807 |
41.2 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.081 |
| 26 |
43 |
|
B |
4 |
2 |
3825 |
◊ |
A |
x,y-1,z |
1_545 |
6 |
1 |
4231 |
39.6 |
-0.3 |
0.377 |
0 |
0 |
0 |
0.000 |
| 27 |
44 |
|
[UNX]C:101 |
1 |
1 |
129 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
2807 |
39.0 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.067 |
| 28 |
45 |
|
[UNX]B:1009 |
1 |
1 |
129 |
◊ |
E |
x,y,z |
1_555 |
8 |
2 |
2816 |
38.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.063 |
46 |
|
[UNX]A:1003 |
1 |
1 |
129 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
2807 |
38.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.063 |
| Average: |
38.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.063 |
| 29 |
47 |
|
D |
7 |
2 |
2807 |
◊ |
[UNX]A:1008 |
x,y-1,z |
1_545 |
1 |
1 |
129 |
37.7 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 30 |
48 |
|
[UNX]A:1006 |
1 |
1 |
129 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
4231 |
34.2 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.020 |
| 31 |
49 |
|
A |
3 |
2 |
4231 |
◊ |
C |
x,y-1,z |
1_545 |
6 |
2 |
2807 |
31.5 |
-0.9 |
0.511 |
1 |
0 |
0 |
0.000 |
| 32 |
50 |
|
[UNX]B:1005 |
1 |
1 |
129 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
4231 |
26.0 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.005 |
51 |
|
[UNX]B:1006 |
1 |
1 |
129 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
4231 |
23.9 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.005 |
| Average: |
25.0 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.005 |
| 33 |
52 |
|
[UNX]B:1006 |
1 |
1 |
129 |
f |
[UNX]B:1005 |
x,y,z |
1_555 |
1 |
1 |
129 |
25.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.049 |
| 34 |
53 |
|
[UNX]B:1007 |
1 |
1 |
129 |
f |
[UNX]B:1006 |
x,y,z |
1_555 |
1 |
1 |
129 |
25.2 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.048 |
| 35 |
54 |
|
C |
5 |
1 |
2807 |
◊ |
F |
-x-1/2,y-1/2,-z |
4_445 |
5 |
1 |
2823 |
21.9 |
-0.2 |
0.544 |
0 |
0 |
0 |
0.000 |
55 |
|
E |
5 |
1 |
2816 |
◊ |
D |
-x,y-1,-z |
2_545 |
4 |
1 |
2807 |
18.8 |
-0.3 |
0.514 |
0 |
0 |
0 |
0.000 |
| Average: |
20.4 |
-0.2 |
0.529 |
0 |
0 |
0 |
0.000 |
| 36 |
56 |
|
[UNX]A:1005 |
1 |
1 |
129 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
2807 |
21.4 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.032 |
57 |
|
[UNX]B:1008 |
1 |
1 |
129 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
2816 |
17.9 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.032 |
| Average: |
19.7 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.032 |
| 37 |
58 |
|
E |
2 |
2 |
2816 |
◊ |
C |
x,y,z-1 |
1_554 |
2 |
2 |
2807 |
15.2 |
-0.9 |
0.321 |
0 |
0 |
0 |
0.000 |
| 38 |
59 |
|
[UNX]B:1007 |
1 |
1 |
129 |
f |
[UNX]B:1005 |
x,y,z |
1_555 |
1 |
1 |
129 |
14.6 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.028 |
| 39 |
60 |
|
[UNX]B:1010 |
1 |
1 |
129 |
f |
[UNX]B:1009 |
x,y,z |
1_555 |
1 |
1 |
129 |
12.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.024 |
| 40 |
61 |
|
B |
2 |
2 |
3825 |
x |
B |
-x-1/2,y-1/2,-z |
4_445 |
2 |
1 |
3825 |
11.5 |
-0.2 |
0.423 |
0 |
0 |
0 |
0.000 |
| 41 |
62 |
|
[UNX]B:1004 |
1 |
1 |
129 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
2816 |
10.7 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.022 |
| 42 |
63 |
|
E |
2 |
2 |
2816 |
◊ |
F |
-x-1/2,y-1/2,-z-1 |
4_444 |
2 |
2 |
2823 |
9.0 |
-0.9 |
0.308 |
0 |
0 |
0 |
0.000 |
| 43 |
64 |
|
C |
1 |
1 |
2807 |
x |
C |
x,y-1,z |
1_545 |
3 |
1 |
2807 |
7.1 |
-0.7 |
0.273 |
0 |
0 |
0 |
0.000 |
65 |
|
E |
1 |
1 |
2816 |
x |
E |
x,y-1,z |
1_545 |
3 |
1 |
2816 |
6.6 |
-0.6 |
0.271 |
0 |
0 |
0 |
0.000 |
| Average: |
6.9 |
-0.7 |
0.272 |
0 |
0 |
0 |
0.000 |
| 44 |
66 |
|
[UNX]C:101 |
1 |
1 |
129 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
4231 |
4.9 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
|