## |
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 |
|
G |
93 |
27 |
8379 |
◊ |
C |
x,y,z |
1_555 |
95 |
27 |
8429 |
847.7 |
-5.7 |
0.572 |
5 |
0 |
0 |
0.000 |
2 |
|
L |
91 |
25 |
8394 |
◊ |
J |
x,y,z |
1_555 |
90 |
26 |
8489 |
811.1 |
-5.9 |
0.510 |
4 |
2 |
0 |
0.000 |
Average: |
829.4 |
-5.8 |
0.541 |
5 |
1 |
0 |
0.000 |
2 |
3 |
|
O |
83 |
23 |
8493 |
◊ |
M |
x,y,z |
1_555 |
82 |
24 |
8353 |
783.7 |
-10.5 |
0.208 |
2 |
3 |
0 |
0.604 |
4 |
|
N |
82 |
23 |
8328 |
◊ |
A |
x,y,z |
1_555 |
85 |
23 |
8408 |
763.0 |
-10.5 |
0.230 |
3 |
2 |
0 |
0.604 |
Average: |
773.3 |
-10.5 |
0.219 |
3 |
3 |
0 |
0.604 |
3 |
5 |
|
C |
43 |
13 |
8429 |
◊ |
M |
x-1,y,z |
1_455 |
39 |
14 |
8353 |
350.6 |
-1.8 |
0.612 |
4 |
0 |
0 |
0.000 |
6 |
|
J |
37 |
11 |
8489 |
◊ |
N |
x-1,y,z |
1_455 |
30 |
12 |
8328 |
286.3 |
-1.7 |
0.612 |
4 |
0 |
0 |
0.000 |
Average: |
318.4 |
-1.7 |
0.612 |
4 |
0 |
0 |
0.000 |
4 |
7 |
|
M |
32 |
16 |
8353 |
◊ |
G |
-x+1,y-1/2,-z |
2_645 |
36 |
15 |
8379 |
304.5 |
-0.4 |
0.725 |
4 |
0 |
0 |
0.000 |
8 |
|
J |
24 |
13 |
8489 |
◊ |
O |
-x+1,y-1/2,-z+1 |
2_646 |
27 |
14 |
8493 |
242.1 |
1.1 |
0.813 |
6 |
0 |
0 |
0.000 |
9 |
|
N |
29 |
15 |
8328 |
◊ |
L |
-x+1,y-1/2,-z+1 |
2_646 |
26 |
13 |
8394 |
234.9 |
0.6 |
0.807 |
4 |
0 |
0 |
0.000 |
Average: |
260.5 |
0.4 |
0.782 |
5 |
0 |
0 |
0.000 |
5 |
10 |
|
L |
31 |
9 |
8394 |
◊ |
A |
x,y,z |
1_555 |
31 |
7 |
8408 |
285.3 |
-2.0 |
0.527 |
3 |
0 |
0 |
0.000 |
11 |
|
O |
32 |
8 |
8493 |
◊ |
G |
x,y,z |
1_555 |
34 |
11 |
8379 |
282.5 |
-1.9 |
0.577 |
4 |
0 |
0 |
0.000 |
12 |
|
M |
30 |
7 |
8353 |
◊ |
C |
x,y,z |
1_555 |
33 |
10 |
8429 |
279.5 |
-1.5 |
0.591 |
5 |
0 |
0 |
0.000 |
13 |
|
N |
30 |
7 |
8328 |
◊ |
J |
x,y,z |
1_555 |
35 |
11 |
8489 |
274.4 |
-2.2 |
0.548 |
4 |
0 |
0 |
0.000 |
Average: |
280.4 |
-1.9 |
0.561 |
4 |
0 |
0 |
0.000 |
6 |
14 |
|
G |
36 |
11 |
8379 |
◊ |
O |
x-1,y,z |
1_455 |
28 |
10 |
8493 |
276.0 |
-1.3 |
0.640 |
2 |
0 |
0 |
0.000 |
7 |
15 |
|
M |
25 |
12 |
8353 |
◊ |
A |
x,y,z-1 |
1_554 |
24 |
11 |
8408 |
256.6 |
-5.1 |
0.123 |
1 |
0 |
0 |
0.000 |
8 |
16 |
|
L |
29 |
12 |
8394 |
◊ |
C |
x,y,z |
1_555 |
27 |
12 |
8429 |
251.1 |
-3.3 |
0.348 |
1 |
0 |
0 |
0.000 |
17 |
|
G |
22 |
11 |
8379 |
◊ |
J |
x,y,z-1 |
1_554 |
27 |
12 |
8489 |
214.7 |
-3.3 |
0.305 |
1 |
0 |
0 |
0.000 |
Average: |
232.9 |
-3.3 |
0.327 |
1 |
0 |
0 |
0.000 |
9 |
18 |
|
O |
27 |
10 |
8493 |
◊ |
N |
x,y,z |
1_555 |
24 |
10 |
8328 |
249.6 |
-3.6 |
0.310 |
2 |
1 |
0 |
0.000 |
10 |
19 |
|
C |
22 |
12 |
8429 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
26 |
13 |
8408 |
236.2 |
1.5 |
0.837 |
5 |
0 |
0 |
0.000 |
11 |
20 |
|
M |
26 |
10 |
8353 |
◊ |
L |
-x+1,y-1/2,-z+1 |
2_646 |
31 |
10 |
8394 |
227.3 |
-3.9 |
0.300 |
1 |
0 |
0 |
0.205 |
21 |
|
J |
24 |
9 |
8489 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
23 |
8 |
8408 |
182.9 |
-3.5 |
0.261 |
1 |
1 |
0 |
0.205 |
Average: |
205.1 |
-3.7 |
0.281 |
1 |
1 |
0 |
0.205 |
12 |
22 |
|
L |
33 |
11 |
8394 |
◊ |
A |
x-1,y,z |
1_455 |
24 |
10 |
8408 |
227.2 |
-0.5 |
0.685 |
4 |
0 |
0 |
0.000 |
13 |
23 |
|
N |
26 |
9 |
8328 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
23 |
7 |
8379 |
209.3 |
-4.0 |
0.220 |
0 |
0 |
0 |
0.023 |
24 |
|
C |
21 |
8 |
8429 |
◊ |
O |
-x+1,y-1/2,-z |
2_645 |
21 |
8 |
8493 |
146.0 |
-3.8 |
0.190 |
0 |
0 |
0 |
0.023 |
Average: |
177.6 |
-3.9 |
0.205 |
0 |
0 |
0 |
0.023 |
14 |
25 |
|
O |
9 |
5 |
8493 |
◊ |
C |
x,y,z |
1_555 |
11 |
5 |
8429 |
86.6 |
1.7 |
0.749 |
0 |
0 |
0 |
0.000 |
26 |
|
M |
6 |
3 |
8353 |
◊ |
G |
x,y,z |
1_555 |
5 |
3 |
8379 |
31.6 |
0.5 |
0.648 |
0 |
0 |
0 |
0.000 |
Average: |
59.1 |
1.1 |
0.699 |
0 |
0 |
0 |
0.000 |
15 |
27 |
|
N |
9 |
5 |
8328 |
◊ |
L |
x,y,z |
1_555 |
11 |
5 |
8394 |
68.1 |
0.5 |
0.589 |
0 |
0 |
0 |
0.000 |
28 |
|
J |
8 |
4 |
8489 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
8408 |
39.1 |
1.3 |
0.866 |
0 |
0 |
0 |
0.000 |
Average: |
53.6 |
0.9 |
0.727 |
0 |
0 |
0 |
0.000 |
16 |
29 |
|
[SO4]J:201 |
4 |
1 |
184 |
◊ |
J |
x,y,z |
1_555 |
11 |
4 |
8489 |
52.8 |
-7.3 |
0.697 |
1 |
0 |
0 |
0.394 |
30 |
|
[SO4]C:201 |
4 |
1 |
189 |
◊ |
C |
x,y,z |
1_555 |
10 |
4 |
8429 |
47.8 |
-6.3 |
0.711 |
1 |
0 |
0 |
0.394 |
Average: |
50.3 |
-6.8 |
0.704 |
1 |
0 |
0 |
0.394 |
17 |
31 |
|
[SO4]J:201 |
4 |
1 |
184 |
f |
A |
-x+1,y-1/2,-z+1 |
2_646 |
6 |
4 |
8408 |
52.2 |
-7.0 |
0.646 |
2 |
0 |
0 |
0.401 |
18 |
32 |
|
[SO4]C:201 |
4 |
1 |
189 |
f |
O |
-x+1,y-1/2,-z |
2_645 |
7 |
3 |
8493 |
48.2 |
-6.2 |
0.713 |
0 |
0 |
0 |
0.100 |
19 |
33 |
|
O |
6 |
2 |
8493 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
8408 |
44.8 |
0.2 |
0.667 |
0 |
0 |
0 |
0.000 |
34 |
|
J |
5 |
2 |
8489 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
8429 |
41.1 |
0.1 |
0.644 |
1 |
0 |
0 |
0.000 |
35 |
|
G |
2 |
1 |
8379 |
◊ |
L |
x,y,z-1 |
1_554 |
4 |
1 |
8394 |
31.3 |
-0.4 |
0.314 |
0 |
0 |
0 |
0.000 |
36 |
|
L |
3 |
1 |
8394 |
◊ |
G |
x,y,z |
1_555 |
4 |
1 |
8379 |
27.4 |
0.1 |
0.690 |
1 |
0 |
0 |
0.000 |
Average: |
36.2 |
0.0 |
0.579 |
1 |
0 |
0 |
0.000 |
20 |
37 |
|
G |
5 |
2 |
8379 |
◊ |
M |
x-1,y,z |
1_455 |
3 |
2 |
8353 |
41.3 |
0.9 |
0.821 |
0 |
0 |
0 |
0.000 |
21 |
38 |
|
L |
2 |
1 |
8394 |
◊ |
N |
x-1,y,z |
1_455 |
3 |
2 |
8328 |
25.1 |
0.4 |
0.809 |
0 |
0 |
0 |
0.000 |
22 |
39 |
|
C |
3 |
1 |
8429 |
◊ |
J |
x,y,z-1 |
1_554 |
2 |
1 |
8489 |
20.5 |
0.2 |
0.746 |
0 |
0 |
0 |
0.000 |
40 |
|
O |
1 |
1 |
8493 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
8408 |
2.4 |
0.0 |
0.607 |
0 |
0 |
0 |
0.000 |
Average: |
11.5 |
0.1 |
0.676 |
0 |
0 |
0 |
0.000 |
23 |
41 |
|
J |
2 |
1 |
8489 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
8408 |
9.5 |
-0.3 |
0.414 |
0 |
0 |
0 |
0.000 |
24 |
42 |
|
N |
1 |
1 |
8328 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
8408 |
4.3 |
0.2 |
0.769 |
0 |
0 |
0 |
0.000 |
|