## |
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 |
|
E |
239 |
57 |
11054 |
◊ |
B |
x,y,z |
1_555 |
228 |
51 |
9744 |
2365.1 |
-27.6 |
0.060 |
34 |
10 |
0 |
0.369 |
2 |
|
A |
217 |
51 |
9417 |
◊ |
A |
-x,y,-z-1 |
2_554 |
219 |
51 |
9417 |
2143.6 |
-23.1 |
0.107 |
28 |
6 |
0 |
0.369 |
Average: |
2254.4 |
-25.4 |
0.084 |
31 |
8 |
0 |
0.369 |
2 |
3 |
|
D |
200 |
49 |
9453 |
◊ |
C |
x,y,z |
1_555 |
204 |
51 |
9579 |
2006.3 |
-29.9 |
0.024 |
28 |
2 |
0 |
0.343 |
3 |
4 |
|
D |
91 |
25 |
9453 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
90 |
24 |
9744 |
787.2 |
-7.4 |
0.360 |
8 |
0 |
0 |
0.086 |
5 |
|
C |
73 |
22 |
9579 |
◊ |
A |
x,y,z |
1_555 |
77 |
22 |
9417 |
654.8 |
-6.3 |
0.315 |
6 |
0 |
0 |
0.086 |
Average: |
721.0 |
-6.9 |
0.337 |
7 |
0 |
0 |
0.086 |
4 |
6 |
|
E |
78 |
24 |
11054 |
◊ |
E |
-x,y,-z-2 |
2_553 |
79 |
24 |
11054 |
733.5 |
-4.0 |
0.523 |
8 |
2 |
0 |
0.000 |
5 |
7 |
|
A |
39 |
12 |
9417 |
◊ |
B |
x,y-1,z |
1_545 |
31 |
10 |
9744 |
322.0 |
-1.7 |
0.491 |
2 |
0 |
0 |
0.000 |
8 |
|
A |
28 |
9 |
9417 |
◊ |
E |
-x,y-1,-z-1 |
2_544 |
40 |
11 |
11054 |
301.2 |
-0.8 |
0.592 |
0 |
3 |
0 |
0.000 |
Average: |
311.6 |
-1.3 |
0.541 |
1 |
2 |
0 |
0.000 |
6 |
9 |
|
B |
28 |
9 |
9744 |
◊ |
A |
x,y,z |
1_555 |
31 |
10 |
9417 |
243.0 |
0.2 |
0.614 |
2 |
0 |
0 |
0.000 |
7 |
10 |
|
D |
24 |
9 |
9453 |
x |
D |
-x+1/2,y-1/2,-z+1 |
4_546 |
27 |
8 |
9453 |
217.9 |
-0.3 |
0.645 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
B |
23 |
10 |
9744 |
◊ |
D |
x,y,z-1 |
1_554 |
35 |
10 |
9453 |
210.5 |
-3.1 |
0.262 |
0 |
0 |
0 |
0.000 |
9 |
12 |
|
A |
26 |
8 |
9417 |
◊ |
C |
x,y-1,z |
1_545 |
21 |
5 |
9579 |
197.3 |
-0.2 |
0.632 |
1 |
1 |
0 |
0.000 |
10 |
13 |
|
A |
27 |
8 |
9417 |
◊ |
E |
x,y-1,z |
1_545 |
24 |
7 |
11054 |
193.4 |
0.4 |
0.689 |
2 |
0 |
0 |
0.000 |
11 |
14 |
|
[SO4]E:201 |
5 |
1 |
188 |
f |
E |
x,y,z |
1_555 |
18 |
9 |
11054 |
108.7 |
-17.6 |
0.663 |
7 |
0 |
0 |
0.173 |
12 |
15 |
|
[SO4]B:201 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
9744 |
106.2 |
-17.0 |
0.716 |
10 |
0 |
0 |
0.179 |
13 |
16 |
|
[SO4]A:201 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
9417 |
105.0 |
-17.6 |
0.682 |
8 |
0 |
0 |
0.269 |
14 |
17 |
|
[SO4]D:201 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
20 |
7 |
9453 |
103.7 |
-17.0 |
0.756 |
4 |
0 |
0 |
0.151 |
15 |
18 |
|
[SO4]E:202 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
17 |
7 |
11054 |
101.8 |
-16.8 |
0.667 |
2 |
0 |
0 |
0.148 |
16 |
19 |
|
[SO4]C:201 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
15 |
7 |
9579 |
101.6 |
-16.0 |
0.708 |
7 |
0 |
0 |
0.183 |
17 |
20 |
|
[SO4]C:202 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
9579 |
96.2 |
-14.6 |
0.599 |
2 |
0 |
0 |
0.149 |
18 |
21 |
|
[SO4]A:202 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
9417 |
95.3 |
-14.3 |
0.683 |
4 |
0 |
0 |
0.204 |
19 |
22 |
|
[SO4]D:202 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
9453 |
94.7 |
-14.6 |
0.650 |
2 |
0 |
0 |
0.125 |
20 |
23 |
|
[SO4]B:202 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
9744 |
93.0 |
-14.8 |
0.679 |
2 |
0 |
0 |
0.131 |
21 |
24 |
|
E |
14 |
6 |
11054 |
◊ |
C |
-x,y,-z-1 |
2_554 |
16 |
5 |
9579 |
89.0 |
1.5 |
0.743 |
0 |
0 |
0 |
0.000 |
22 |
25 |
|
C |
11 |
5 |
9579 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
9744 |
82.7 |
1.4 |
0.811 |
3 |
0 |
0 |
0.000 |
23 |
26 |
|
A |
7 |
3 |
9417 |
◊ |
D |
-x+1/2,y-1/2,-z |
4_545 |
9 |
4 |
9453 |
67.9 |
1.6 |
0.846 |
0 |
0 |
0 |
0.000 |
27 |
|
C |
8 |
4 |
9579 |
◊ |
E |
-x,y-1,-z-1 |
2_544 |
7 |
3 |
11054 |
51.8 |
0.6 |
0.745 |
0 |
0 |
0 |
0.000 |
Average: |
59.9 |
1.1 |
0.796 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
[SO4]B:203 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
9417 |
60.3 |
-8.4 |
0.777 |
3 |
0 |
0 |
0.123 |
25 |
29 |
|
[SO4]B:203 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
9744 |
59.5 |
-6.7 |
0.861 |
2 |
0 |
0 |
0.000 |
26 |
30 |
|
D |
5 |
2 |
9453 |
◊ |
B |
x,y-1,z+1 |
1_546 |
5 |
2 |
9744 |
58.3 |
0.6 |
0.756 |
1 |
0 |
0 |
0.000 |
27 |
31 |
|
[SO4]A:203 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
9417 |
56.7 |
-7.5 |
0.804 |
1 |
0 |
0 |
0.101 |
28 |
32 |
|
[SO4]D:203 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
9453 |
52.2 |
-6.8 |
0.789 |
1 |
0 |
0 |
0.059 |
29 |
33 |
|
[SO4]A:203 |
5 |
1 |
186 |
◊ |
A |
-x,y,-z-1 |
2_554 |
6 |
3 |
9417 |
44.1 |
-5.2 |
0.670 |
1 |
0 |
0 |
0.072 |
30 |
34 |
|
[SO4]B:203 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
9 |
2 |
9579 |
43.8 |
-5.9 |
0.661 |
0 |
0 |
0 |
0.056 |
31 |
35 |
|
[SO4]D:203 |
3 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
9579 |
40.0 |
-4.5 |
0.867 |
1 |
0 |
0 |
0.040 |
32 |
36 |
|
B |
2 |
1 |
9744 |
x |
B |
x,y-1,z |
1_545 |
3 |
1 |
9744 |
33.7 |
-0.1 |
0.380 |
0 |
0 |
0 |
0.000 |
33 |
37 |
|
[SO4]A:202 |
3 |
1 |
186 |
◊ |
B |
x,y-1,z |
1_545 |
3 |
1 |
9744 |
23.9 |
-2.5 |
0.897 |
0 |
0 |
0 |
0.000 |
34 |
38 |
|
B |
6 |
3 |
9744 |
◊ |
D |
-x+1/2,y-1/2,-z |
4_545 |
2 |
1 |
9453 |
20.1 |
0.3 |
0.656 |
0 |
0 |
0 |
0.000 |
35 |
39 |
|
A |
1 |
1 |
9417 |
◊ |
[SO4]E:202 |
-x,y-1,-z-1 |
2_544 |
1 |
1 |
186 |
14.9 |
-1.6 |
0.825 |
0 |
0 |
0 |
0.000 |
36 |
40 |
|
[SO4]D:201 |
2 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
9579 |
7.0 |
-0.5 |
0.926 |
0 |
0 |
0 |
0.004 |
37 |
41 |
|
[SO4]A:201 |
1 |
1 |
187 |
◊ |
A |
-x,y,-z-1 |
2_554 |
1 |
1 |
9417 |
0.4 |
-0.0 |
0.824 |
0 |
0 |
0 |
0.000 |
|