## |
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 |
|
C |
117 |
32 |
11256 |
◊ |
A |
-x+2,y-1/2,-z |
2_745 |
120 |
32 |
10882 |
1200.9 |
-21.7 |
0.012 |
5 |
4 |
0 |
0.000 |
2 |
|
D |
117 |
32 |
11288 |
◊ |
B |
x,y,z |
1_555 |
114 |
32 |
11326 |
1184.4 |
-21.7 |
0.010 |
4 |
4 |
0 |
0.000 |
Average: |
1192.7 |
-21.7 |
0.011 |
5 |
4 |
0 |
0.000 |
2 |
3 |
|
A |
92 |
27 |
10882 |
◊ |
C |
x,y,z-1 |
1_554 |
113 |
28 |
11256 |
866.9 |
2.4 |
0.862 |
20 |
10 |
0 |
0.000 |
4 |
|
D |
99 |
32 |
11288 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
123 |
36 |
11326 |
858.7 |
2.1 |
0.856 |
13 |
8 |
0 |
0.000 |
5 |
|
D |
105 |
30 |
11288 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
91 |
29 |
11326 |
830.6 |
4.6 |
0.893 |
17 |
11 |
0 |
0.000 |
6 |
|
A |
101 |
28 |
10882 |
◊ |
C |
x-1,y,z-1 |
1_454 |
90 |
28 |
11256 |
795.3 |
4.0 |
0.907 |
14 |
8 |
0 |
0.000 |
Average: |
837.9 |
3.3 |
0.879 |
16 |
9 |
0 |
0.000 |
3 |
7 |
|
[PG6]C:201 |
18 |
1 |
550 |
◊ |
C |
x,y,z |
1_555 |
68 |
22 |
11256 |
385.6 |
7.3 |
0.422 |
0 |
0 |
0 |
0.000 |
8 |
|
[PG6]A:202 |
18 |
1 |
550 |
◊ |
A |
x,y,z |
1_555 |
65 |
21 |
10882 |
378.3 |
7.5 |
0.419 |
0 |
0 |
0 |
0.000 |
9 |
|
[PG6]D:201 |
18 |
1 |
549 |
◊ |
D |
x,y,z |
1_555 |
67 |
21 |
11288 |
376.3 |
7.3 |
0.451 |
0 |
0 |
0 |
0.000 |
Average: |
380.1 |
7.3 |
0.431 |
0 |
0 |
0 |
0.000 |
4 |
10 |
|
[PG6]B:202 |
18 |
1 |
551 |
◊ |
B |
x,y,z |
1_555 |
62 |
20 |
11326 |
379.8 |
6.9 |
0.352 |
0 |
0 |
0 |
0.000 |
5 |
11 |
|
D |
21 |
6 |
11288 |
◊ |
C |
x-1,y,z-1 |
1_454 |
27 |
7 |
11256 |
238.1 |
0.6 |
0.681 |
2 |
2 |
0 |
0.000 |
6 |
12 |
|
C |
28 |
9 |
11256 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
22 |
7 |
11326 |
215.7 |
2.0 |
0.838 |
5 |
5 |
0 |
0.000 |
7 |
13 |
|
D |
20 |
4 |
11288 |
x |
D |
-x+1,y-1/2,-z |
2_645 |
28 |
9 |
11288 |
206.0 |
-2.4 |
0.325 |
2 |
1 |
0 |
0.000 |
14 |
|
C |
30 |
10 |
11256 |
x |
C |
-x+2,y-1/2,-z+1 |
2_746 |
19 |
3 |
11256 |
205.1 |
-2.1 |
0.338 |
2 |
1 |
0 |
0.000 |
15 |
|
B |
30 |
9 |
11326 |
x |
B |
-x+2,y-1/2,-z |
2_745 |
17 |
3 |
11326 |
196.4 |
-1.9 |
0.368 |
1 |
1 |
0 |
0.000 |
16 |
|
A |
17 |
3 |
10882 |
x |
A |
-x+1,y-1/2,-z-1 |
2_644 |
28 |
9 |
10882 |
192.1 |
-1.8 |
0.399 |
1 |
2 |
0 |
0.000 |
Average: |
199.9 |
-2.0 |
0.358 |
2 |
1 |
0 |
0.000 |
8 |
17 |
|
A |
19 |
5 |
10882 |
◊ |
B |
-x+1,y-1/2,-z-1 |
2_644 |
21 |
5 |
11326 |
173.2 |
-0.7 |
0.479 |
0 |
0 |
0 |
0.000 |
9 |
18 |
|
C |
16 |
3 |
11256 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
20 |
7 |
11326 |
170.9 |
2.5 |
0.862 |
2 |
4 |
0 |
0.000 |
10 |
19 |
|
A |
19 |
4 |
10882 |
◊ |
D |
x,y,z-1 |
1_554 |
17 |
6 |
11288 |
164.5 |
-0.2 |
0.641 |
2 |
0 |
0 |
0.000 |
11 |
20 |
|
[SO4]A:200 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
10882 |
105.3 |
-16.4 |
0.720 |
6 |
0 |
0 |
0.056 |
12 |
21 |
|
[SO4]D:200 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
14 |
5 |
11288 |
100.4 |
-14.7 |
0.825 |
5 |
0 |
0 |
0.102 |
13 |
22 |
|
[SO4]C:200 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
18 |
6 |
11256 |
99.6 |
-15.6 |
0.704 |
3 |
0 |
0 |
0.094 |
14 |
23 |
|
[SO4]B:200 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
11326 |
96.7 |
-15.8 |
0.740 |
4 |
0 |
0 |
0.054 |
15 |
24 |
|
D |
12 |
3 |
11288 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
10882 |
91.8 |
1.3 |
0.683 |
1 |
0 |
0 |
0.000 |
16 |
25 |
|
A |
12 |
4 |
10882 |
◊ |
C |
-x+2,y-1/2,-z |
2_745 |
10 |
3 |
11256 |
90.4 |
-0.1 |
0.599 |
0 |
0 |
0 |
0.000 |
26 |
|
D |
10 |
3 |
11288 |
◊ |
B |
x,y-1,z |
1_545 |
8 |
2 |
11326 |
76.9 |
-0.4 |
0.444 |
0 |
0 |
0 |
0.000 |
Average: |
83.6 |
-0.3 |
0.521 |
0 |
0 |
0 |
0.000 |
17 |
27 |
|
C |
8 |
2 |
11256 |
◊ |
A |
-x+3,y-1/2,-z |
2_845 |
8 |
2 |
10882 |
76.4 |
-0.1 |
0.630 |
0 |
0 |
0 |
0.000 |
28 |
|
B |
8 |
2 |
11326 |
◊ |
D |
x-1,y,z |
1_455 |
8 |
2 |
11288 |
75.6 |
-0.1 |
0.620 |
0 |
0 |
0 |
0.000 |
Average: |
76.0 |
-0.1 |
0.625 |
0 |
0 |
0 |
0.000 |
18 |
29 |
|
[SO4]B:201 |
5 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
11326 |
75.7 |
-12.6 |
0.647 |
3 |
0 |
0 |
0.043 |
19 |
30 |
|
[SO4]A:201 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
10882 |
72.8 |
-11.8 |
0.686 |
4 |
0 |
0 |
0.039 |
20 |
31 |
|
[PG6]C:201 |
4 |
1 |
550 |
f |
A |
-x+2,y-1/2,-z |
2_745 |
10 |
3 |
10882 |
52.0 |
-1.7 |
0.104 |
0 |
0 |
0 |
0.006 |
32 |
|
[PG6]D:201 |
4 |
1 |
549 |
f |
B |
x,y,z |
1_555 |
9 |
2 |
11326 |
48.3 |
-1.0 |
0.155 |
0 |
0 |
0 |
0.006 |
33 |
|
C |
7 |
2 |
11256 |
f |
[PG6]A:202 |
-x+2,y-1/2,-z |
2_745 |
3 |
1 |
550 |
41.3 |
-1.0 |
0.148 |
0 |
0 |
0 |
0.006 |
Average: |
47.2 |
-1.2 |
0.136 |
0 |
0 |
0 |
0.006 |
21 |
34 |
|
C |
9 |
5 |
11256 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
9 |
5 |
10882 |
50.5 |
-0.9 |
0.467 |
0 |
0 |
0 |
0.000 |
35 |
|
D |
5 |
3 |
11288 |
◊ |
B |
x-1,y,z |
1_455 |
8 |
4 |
11326 |
46.6 |
-1.1 |
0.334 |
0 |
0 |
0 |
0.000 |
Average: |
48.5 |
-1.0 |
0.401 |
0 |
0 |
0 |
0.000 |
22 |
36 |
|
B |
6 |
3 |
11326 |
◊ |
[SO4]B:201 |
-x+2,y-1/2,-z |
2_745 |
4 |
1 |
183 |
47.1 |
-6.7 |
0.543 |
2 |
0 |
0 |
0.000 |
23 |
37 |
|
[SO4]A:201 |
5 |
1 |
184 |
◊ |
A |
-x+1,y-1/2,-z-1 |
2_644 |
5 |
3 |
10882 |
46.0 |
-6.7 |
0.560 |
1 |
0 |
0 |
0.000 |
24 |
38 |
|
[SO4]A:201 |
4 |
1 |
184 |
◊ |
C |
-x+2,y-1/2,-z |
2_745 |
5 |
2 |
11256 |
33.2 |
-2.5 |
0.915 |
2 |
0 |
0 |
0.000 |
25 |
39 |
|
[PG6]B:202 |
1 |
1 |
551 |
f |
D |
x,y,z |
1_555 |
5 |
1 |
11288 |
27.7 |
0.4 |
0.346 |
0 |
0 |
0 |
0.000 |
26 |
40 |
|
D |
5 |
2 |
11288 |
◊ |
[SO4]B:201 |
x,y-1,z |
1_545 |
4 |
1 |
183 |
24.1 |
-2.2 |
0.806 |
0 |
0 |
0 |
0.000 |
27 |
41 |
|
[SO4]D:200 |
1 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10882 |
7.0 |
-0.8 |
0.803 |
0 |
0 |
0 |
0.000 |
28 |
42 |
|
D |
1 |
1 |
11288 |
x |
D |
x-1,y,z |
1_455 |
1 |
1 |
11288 |
5.6 |
0.2 |
0.810 |
0 |
0 |
0 |
0.000 |
43 |
|
C |
1 |
1 |
11256 |
x |
C |
x-1,y,z |
1_455 |
1 |
1 |
11256 |
1.7 |
0.1 |
0.764 |
0 |
0 |
0 |
0.000 |
Average: |
3.7 |
0.1 |
0.787 |
0 |
0 |
0 |
0.000 |
29 |
44 |
|
[SO4]A:200 |
1 |
1 |
185 |
◊ |
D |
x,y,z-1 |
1_554 |
1 |
1 |
11288 |
3.2 |
-0.4 |
0.640 |
0 |
0 |
0 |
0.000 |
30 |
45 |
|
D |
2 |
1 |
11288 |
◊ |
C |
x,y,z-1 |
1_554 |
1 |
1 |
11256 |
2.9 |
0.1 |
0.743 |
0 |
0 |
0 |
0.000 |
31 |
46 |
|
[SO4]C:200 |
1 |
1 |
185 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
11326 |
0.7 |
-0.1 |
0.850 |
0 |
0 |
0 |
0.000 |
32 |
47 |
|
D |
1 |
1 |
11288 |
◊ |
[SO4]B:201 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
183 |
0.5 |
-0.1 |
0.768 |
0 |
0 |
0 |
0.000 |
33 |
48 |
|
[SO4]A:201 |
1 |
1 |
184 |
◊ |
C |
x,y,z-1 |
1_554 |
1 |
1 |
11256 |
0.4 |
-0.0 |
0.763 |
0 |
0 |
0 |
0.000 |
|