| ## |
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 |
|
D |
148 |
43 |
15628 |
◊ |
A |
x,y,z |
1_555 |
143 |
40 |
15732 |
1344.6 |
-8.3 |
0.293 |
10 |
3 |
0 |
0.129 |
| 2 |
2 |
|
B |
133 |
34 |
6717 |
◊ |
A |
x,y,z |
1_555 |
143 |
40 |
15732 |
1332.1 |
-12.9 |
0.109 |
19 |
6 |
0 |
1.000 |
3 |
|
E |
132 |
34 |
6718 |
◊ |
D |
x,y,z |
1_555 |
136 |
42 |
15628 |
1279.0 |
-12.3 |
0.113 |
19 |
7 |
0 |
1.000 |
| Average: |
1305.5 |
-12.6 |
0.111 |
19 |
7 |
0 |
1.000 |
| 3 |
4 |
|
C |
72 |
9 |
1515 |
◊ |
A |
x,y,z |
1_555 |
123 |
39 |
15732 |
998.9 |
-8.7 |
0.279 |
26 |
5 |
0 |
1.000 |
5 |
|
F |
74 |
9 |
1504 |
◊ |
D |
x,y,z |
1_555 |
125 |
43 |
15628 |
984.4 |
-9.2 |
0.280 |
17 |
4 |
0 |
1.000 |
| Average: |
991.6 |
-9.0 |
0.280 |
22 |
5 |
0 |
1.000 |
| 4 |
6 |
|
A |
35 |
11 |
15732 |
◊ |
D |
x-1,y,z |
1_455 |
42 |
13 |
15628 |
311.2 |
0.5 |
0.666 |
4 |
0 |
0 |
0.000 |
7 |
|
D |
34 |
10 |
15628 |
◊ |
A |
x,y-1,z |
1_545 |
44 |
13 |
15732 |
295.7 |
0.3 |
0.647 |
4 |
0 |
0 |
0.000 |
| Average: |
303.5 |
0.4 |
0.657 |
4 |
0 |
0 |
0.000 |
| 5 |
8 |
|
A |
35 |
11 |
15732 |
◊ |
E |
x-1,y+1,z |
1_465 |
28 |
11 |
6718 |
281.2 |
-1.6 |
0.436 |
2 |
0 |
0 |
0.000 |
9 |
|
B |
25 |
11 |
6717 |
◊ |
D |
x-1,y+1,z |
1_465 |
33 |
11 |
15628 |
271.5 |
0.7 |
0.659 |
2 |
1 |
0 |
0.000 |
| Average: |
276.4 |
-0.4 |
0.548 |
2 |
1 |
0 |
0.000 |
| 6 |
10 |
|
E |
31 |
7 |
6718 |
◊ |
B |
x,y,z |
1_555 |
32 |
8 |
6717 |
273.0 |
-1.2 |
0.485 |
4 |
0 |
0 |
0.029 |
| 7 |
11 |
|
B |
21 |
8 |
6717 |
◊ |
D |
x,y,z |
1_555 |
30 |
11 |
15628 |
212.6 |
-1.1 |
0.440 |
4 |
0 |
0 |
0.044 |
12 |
|
E |
15 |
6 |
6718 |
◊ |
A |
x,y,z |
1_555 |
24 |
8 |
15732 |
150.8 |
-1.0 |
0.397 |
1 |
1 |
0 |
0.044 |
| Average: |
181.7 |
-1.0 |
0.418 |
3 |
1 |
0 |
0.044 |
| 8 |
13 |
|
A |
19 |
6 |
15732 |
x |
A |
x,y,z-1 |
1_554 |
20 |
7 |
15732 |
166.3 |
-0.2 |
0.550 |
1 |
0 |
0 |
0.000 |
| 9 |
14 |
|
A |
27 |
10 |
15732 |
◊ |
D |
x-1,y,z+1 |
1_456 |
17 |
6 |
15628 |
155.5 |
0.0 |
0.576 |
1 |
2 |
0 |
0.000 |
| 10 |
15 |
|
A |
14 |
5 |
15732 |
◊ |
F |
x-1,y,z+1 |
1_456 |
19 |
6 |
1504 |
142.0 |
-0.2 |
0.649 |
2 |
0 |
0 |
0.000 |
| 11 |
16 |
|
[GOL]E:302 |
6 |
1 |
221 |
f |
E |
x,y,z |
1_555 |
16 |
9 |
6718 |
117.7 |
1.2 |
0.759 |
7 |
0 |
0 |
0.030 |
| 12 |
17 |
|
[EDO]E:301 |
4 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
18 |
7 |
6718 |
115.0 |
3.2 |
0.436 |
6 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[SO4]E:304 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
22 |
7 |
6718 |
110.2 |
-17.6 |
0.635 |
3 |
0 |
0 |
0.292 |
| 14 |
19 |
|
[EDO]B:101 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
18 |
10 |
6717 |
99.5 |
3.1 |
0.463 |
3 |
0 |
0 |
0.000 |
| 15 |
20 |
|
[EDO]A:301 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
15732 |
95.3 |
2.3 |
0.394 |
1 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[SO4]E:303 |
5 |
1 |
187 |
f |
E |
x,y,z |
1_555 |
17 |
9 |
6718 |
88.0 |
-12.0 |
0.761 |
3 |
0 |
0 |
0.204 |
| 17 |
22 |
|
D |
8 |
3 |
15628 |
◊ |
A |
x,y,z-1 |
1_554 |
7 |
3 |
15732 |
82.5 |
0.8 |
0.744 |
0 |
0 |
0 |
0.000 |
| 18 |
23 |
|
D |
11 |
4 |
15628 |
x |
D |
x-1,y,z+1 |
1_456 |
8 |
3 |
15628 |
70.5 |
0.4 |
0.573 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
A |
9 |
2 |
15732 |
◊ |
E |
x-1,y,z |
1_455 |
7 |
2 |
6718 |
68.6 |
0.3 |
0.611 |
1 |
0 |
0 |
0.000 |
25 |
|
D |
6 |
2 |
15628 |
◊ |
B |
x,y-1,z |
1_545 |
8 |
3 |
6717 |
53.2 |
0.2 |
0.585 |
1 |
0 |
0 |
0.000 |
| Average: |
60.9 |
0.3 |
0.598 |
1 |
0 |
0 |
0.000 |
| 20 |
26 |
|
[SO4]E:303 |
5 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
15628 |
65.2 |
-8.8 |
0.729 |
2 |
0 |
0 |
0.149 |
| 21 |
27 |
|
A |
8 |
3 |
15732 |
x |
A |
x-1,y,z |
1_455 |
4 |
1 |
15732 |
56.8 |
1.0 |
0.805 |
0 |
0 |
0 |
0.000 |
28 |
|
D |
4 |
2 |
15628 |
x |
D |
x,y-1,z |
1_545 |
3 |
1 |
15628 |
40.1 |
1.1 |
0.873 |
0 |
0 |
0 |
0.000 |
| Average: |
48.4 |
1.0 |
0.839 |
0 |
0 |
0 |
0.000 |
| 22 |
29 |
|
D |
7 |
3 |
15628 |
◊ |
F |
x-1,y,z+1 |
1_456 |
3 |
1 |
1504 |
50.4 |
0.8 |
0.635 |
1 |
0 |
0 |
0.000 |
| 23 |
30 |
|
[EDO]B:101 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
15732 |
36.1 |
1.6 |
0.931 |
0 |
0 |
0 |
0.000 |
| 24 |
31 |
|
[GOL]E:302 |
5 |
1 |
221 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
15628 |
34.3 |
0.0 |
0.583 |
1 |
0 |
0 |
0.006 |
| 25 |
32 |
|
[EDO]A:301 |
2 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
6717 |
29.2 |
0.1 |
0.532 |
0 |
0 |
0 |
0.000 |
| 26 |
33 |
|
A |
5 |
3 |
15732 |
◊ |
D |
x-1,y+1,z+1 |
1_466 |
4 |
2 |
15628 |
22.3 |
0.9 |
0.804 |
0 |
0 |
0 |
0.000 |
| 27 |
34 |
|
B |
5 |
2 |
6717 |
◊ |
E |
x-1,y+1,z |
1_465 |
5 |
2 |
6718 |
20.1 |
-0.1 |
0.548 |
0 |
0 |
0 |
0.000 |
| 28 |
35 |
|
A |
1 |
1 |
15732 |
◊ |
[SO4]E:304 |
x-1,y,z |
1_455 |
4 |
1 |
186 |
19.2 |
-1.8 |
0.937 |
0 |
0 |
0 |
0.000 |
| 29 |
36 |
|
D |
3 |
1 |
15628 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
6718 |
12.4 |
0.3 |
0.773 |
0 |
0 |
0 |
0.000 |
| 30 |
37 |
|
[EDO]E:301 |
1 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
15628 |
9.4 |
0.5 |
0.973 |
0 |
0 |
0 |
0.000 |
| 31 |
38 |
|
[EDO]A:301 |
1 |
1 |
182 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
15628 |
7.9 |
0.4 |
0.917 |
0 |
0 |
0 |
0.000 |
| 32 |
39 |
|
E |
2 |
1 |
6718 |
◊ |
A |
x,y-1,z |
1_545 |
2 |
1 |
15732 |
7.8 |
0.1 |
0.666 |
0 |
0 |
0 |
0.000 |
40 |
|
B |
2 |
1 |
6717 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
15628 |
6.4 |
0.1 |
0.718 |
0 |
0 |
0 |
0.000 |
| Average: |
7.1 |
0.1 |
0.692 |
0 |
0 |
0 |
0.000 |
|