## |
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 |
71 |
23 |
6457 |
◊ |
C |
x,y,z |
1_555 |
66 |
22 |
6656 |
699.1 |
-0.1 |
0.616 |
16 |
0 |
0 |
0.000 |
2 |
|
B |
70 |
22 |
6580 |
◊ |
A |
x,y,z |
1_555 |
67 |
23 |
6531 |
677.1 |
1.6 |
0.711 |
19 |
0 |
0 |
0.000 |
3 |
|
H |
65 |
19 |
6576 |
◊ |
E |
x,y,z |
1_555 |
67 |
22 |
6571 |
657.7 |
0.5 |
0.651 |
19 |
0 |
0 |
0.000 |
4 |
|
G |
59 |
20 |
6414 |
◊ |
D |
x,y,z |
1_555 |
70 |
23 |
6536 |
598.9 |
-0.3 |
0.618 |
15 |
0 |
0 |
0.000 |
Average: |
658.2 |
0.4 |
0.649 |
17 |
0 |
0 |
0.000 |
2 |
5 |
|
E |
49 |
17 |
6571 |
◊ |
D |
x,y,z |
1_555 |
47 |
17 |
6536 |
427.0 |
-0.3 |
0.605 |
10 |
0 |
0 |
0.000 |
6 |
|
F |
50 |
18 |
6457 |
◊ |
A |
x,y,z |
1_555 |
46 |
16 |
6531 |
424.3 |
-0.6 |
0.570 |
14 |
0 |
0 |
0.000 |
7 |
|
C |
42 |
14 |
6656 |
◊ |
B |
x,y,z |
1_555 |
50 |
18 |
6580 |
412.7 |
0.4 |
0.606 |
12 |
0 |
0 |
0.000 |
8 |
|
H |
44 |
15 |
6576 |
◊ |
G |
x,y,z |
1_555 |
41 |
15 |
6414 |
363.0 |
-1.5 |
0.482 |
11 |
0 |
0 |
0.000 |
Average: |
406.7 |
-0.5 |
0.566 |
12 |
0 |
0 |
0.000 |
3 |
9 |
|
D |
37 |
9 |
6536 |
◊ |
B |
-x+2,y-1/2,-z+2 |
2_747 |
38 |
12 |
6580 |
336.2 |
-1.4 |
0.465 |
2 |
3 |
0 |
0.051 |
4 |
10 |
|
H |
28 |
7 |
6576 |
◊ |
B |
-x+2,y-1/2,-z+3 |
2_748 |
27 |
7 |
6580 |
285.0 |
0.8 |
0.691 |
3 |
8 |
0 |
0.000 |
5 |
11 |
|
A |
35 |
9 |
6531 |
◊ |
B |
x-1,y,z |
1_455 |
35 |
9 |
6580 |
281.2 |
0.8 |
0.676 |
6 |
0 |
0 |
0.000 |
12 |
|
E |
33 |
10 |
6571 |
◊ |
H |
x-1,y,z |
1_455 |
36 |
10 |
6576 |
279.4 |
0.7 |
0.682 |
5 |
0 |
0 |
0.000 |
13 |
|
D |
34 |
10 |
6536 |
◊ |
G |
x-1,y,z |
1_455 |
36 |
10 |
6414 |
271.6 |
0.2 |
0.647 |
6 |
0 |
0 |
0.000 |
14 |
|
F |
31 |
10 |
6457 |
◊ |
C |
x-1,y,z |
1_455 |
31 |
10 |
6656 |
264.4 |
0.4 |
0.639 |
6 |
0 |
0 |
0.000 |
Average: |
274.2 |
0.5 |
0.661 |
6 |
0 |
0 |
0.000 |
6 |
15 |
|
G |
29 |
7 |
6414 |
◊ |
F |
x,y,z-1 |
1_554 |
25 |
7 |
6457 |
274.1 |
-1.5 |
0.412 |
0 |
0 |
0 |
0.000 |
7 |
16 |
|
E |
34 |
11 |
6571 |
◊ |
C |
x,y,z |
1_555 |
35 |
13 |
6656 |
269.6 |
0.5 |
0.629 |
3 |
0 |
0 |
0.000 |
8 |
17 |
|
C |
23 |
9 |
6656 |
◊ |
A |
x,y,z |
1_555 |
21 |
9 |
6531 |
192.9 |
0.5 |
0.645 |
0 |
0 |
0 |
0.000 |
18 |
|
G |
19 |
8 |
6414 |
◊ |
E |
x,y,z |
1_555 |
21 |
8 |
6571 |
173.7 |
-0.4 |
0.539 |
0 |
0 |
0 |
0.000 |
Average: |
183.3 |
0.0 |
0.592 |
0 |
0 |
0 |
0.000 |
9 |
19 |
|
H |
18 |
7 |
6576 |
◊ |
C |
x,y,z |
1_555 |
15 |
5 |
6656 |
135.2 |
-0.6 |
0.362 |
0 |
1 |
0 |
0.000 |
20 |
|
F |
17 |
6 |
6457 |
◊ |
E |
x,y,z |
1_555 |
17 |
5 |
6571 |
125.0 |
0.1 |
0.500 |
2 |
3 |
0 |
0.000 |
Average: |
130.1 |
-0.3 |
0.431 |
1 |
2 |
0 |
0.000 |
10 |
21 |
|
D |
14 |
5 |
6536 |
◊ |
A |
-x+1,y-1/2,-z+2 |
2_647 |
14 |
4 |
6531 |
123.5 |
-1.3 |
0.352 |
0 |
0 |
0 |
0.000 |
11 |
22 |
|
[SO4]A:201 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
6531 |
103.1 |
-15.7 |
0.717 |
7 |
0 |
0 |
0.054 |
12 |
23 |
|
G |
10 |
3 |
6414 |
◊ |
A |
-x+2,y-1/2,-z+2 |
2_747 |
15 |
4 |
6531 |
102.2 |
-1.6 |
0.253 |
0 |
0 |
0 |
0.000 |
13 |
24 |
|
[SO4]G:203 |
5 |
1 |
186 |
f |
G |
x,y,z |
1_555 |
16 |
9 |
6414 |
100.9 |
-14.6 |
0.769 |
6 |
0 |
0 |
0.038 |
14 |
25 |
|
[SO4]E:202 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
17 |
8 |
6571 |
100.9 |
-16.1 |
0.716 |
3 |
0 |
0 |
0.030 |
15 |
26 |
|
[SO4]C:202 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
15 |
8 |
6656 |
100.2 |
-14.8 |
0.729 |
7 |
0 |
0 |
0.036 |
16 |
27 |
|
[SO4]F:201 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
14 |
8 |
6457 |
99.4 |
-14.7 |
0.730 |
4 |
0 |
0 |
0.036 |
17 |
28 |
|
[SO4]B:201 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
6580 |
99.0 |
-14.8 |
0.729 |
4 |
0 |
0 |
0.311 |
18 |
29 |
|
[SO4]E:201 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
17 |
8 |
6571 |
91.9 |
-14.3 |
0.701 |
6 |
0 |
0 |
0.029 |
19 |
30 |
|
[SO4]A:202 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
6531 |
90.7 |
-14.7 |
0.683 |
3 |
0 |
0 |
0.046 |
20 |
31 |
|
[SO4]H:203 |
5 |
1 |
184 |
f |
H |
x,y,z |
1_555 |
13 |
5 |
6576 |
89.7 |
-12.6 |
0.747 |
2 |
0 |
0 |
0.033 |
21 |
32 |
|
[SO4]H:202 |
5 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
12 |
4 |
6576 |
89.4 |
-11.4 |
0.864 |
3 |
0 |
0 |
0.031 |
22 |
33 |
|
[SO4]D:201 |
5 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
13 |
7 |
6536 |
88.3 |
-14.0 |
0.641 |
4 |
0 |
0 |
0.297 |
23 |
34 |
|
[SO4]C:203 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
6656 |
86.5 |
-12.5 |
0.732 |
3 |
0 |
0 |
0.028 |
24 |
35 |
|
[SO4]F:203 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
15 |
7 |
6457 |
86.2 |
-14.2 |
0.717 |
4 |
0 |
0 |
0.035 |
25 |
36 |
|
[SO4]C:201 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
6656 |
85.3 |
-14.0 |
0.641 |
8 |
0 |
0 |
0.036 |
26 |
37 |
|
[SO4]G:201 |
5 |
1 |
186 |
f |
G |
x,y,z |
1_555 |
14 |
7 |
6414 |
84.9 |
-12.9 |
0.667 |
4 |
0 |
0 |
0.032 |
27 |
38 |
|
[SO4]H:201 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
14 |
7 |
6576 |
84.7 |
-13.1 |
0.707 |
5 |
0 |
0 |
0.037 |
28 |
39 |
|
[SO4]F:202 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
12 |
6 |
6457 |
84.3 |
-11.9 |
0.703 |
4 |
0 |
0 |
0.030 |
29 |
40 |
|
[SO4]G:202 |
5 |
1 |
185 |
f |
G |
x,y,z |
1_555 |
11 |
6 |
6414 |
83.7 |
-12.1 |
0.740 |
4 |
0 |
0 |
0.030 |
30 |
41 |
|
[SO4]E:203 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
11 |
6 |
6571 |
83.7 |
-11.7 |
0.720 |
3 |
0 |
0 |
0.023 |
31 |
42 |
|
[SO4]B:202 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
6580 |
82.3 |
-12.1 |
0.669 |
3 |
0 |
0 |
0.253 |
32 |
43 |
|
[SO4]E:204 |
4 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
11 |
6 |
6571 |
69.0 |
-9.7 |
0.651 |
2 |
0 |
0 |
0.018 |
33 |
44 |
|
[SO4]C:201 |
4 |
1 |
185 |
◊ |
H |
x,y,z |
1_555 |
5 |
2 |
6576 |
49.6 |
-5.6 |
0.884 |
1 |
0 |
0 |
0.000 |
34 |
45 |
|
[SO4]D:201 |
4 |
1 |
186 |
cf |
B |
-x+2,y-1/2,-z+2 |
2_747 |
4 |
1 |
6580 |
45.7 |
-4.6 |
0.967 |
0 |
0 |
0 |
0.087 |
35 |
46 |
|
[SO4]E:201 |
4 |
1 |
185 |
◊ |
F |
x,y,z |
1_555 |
6 |
2 |
6457 |
45.4 |
-4.8 |
0.908 |
1 |
0 |
0 |
0.000 |
36 |
47 |
|
[SO4]C:202 |
3 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
6571 |
29.1 |
-2.8 |
0.964 |
1 |
0 |
0 |
0.000 |
37 |
48 |
|
[SO4]H:203 |
3 |
1 |
184 |
◊ |
B |
-x+2,y-1/2,-z+3 |
2_748 |
2 |
1 |
6580 |
26.0 |
-2.9 |
0.657 |
0 |
0 |
0 |
0.000 |
38 |
49 |
|
[SO4]E:204 |
3 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
6536 |
16.4 |
-2.2 |
0.677 |
0 |
0 |
0 |
0.000 |
39 |
50 |
|
[SO4]D:201 |
1 |
1 |
186 |
◊ |
A |
-x+1,y-1/2,-z+2 |
2_647 |
1 |
1 |
6531 |
5.1 |
-0.5 |
0.785 |
0 |
0 |
0 |
0.000 |
40 |
51 |
|
[SO4]H:202 |
1 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
6571 |
4.8 |
-0.4 |
0.821 |
0 |
0 |
0 |
0.000 |
41 |
52 |
|
[SO4]F:202 |
1 |
1 |
185 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
6656 |
4.7 |
-0.4 |
0.818 |
0 |
0 |
0 |
0.000 |
42 |
53 |
|
H |
1 |
1 |
6576 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
6536 |
3.4 |
0.1 |
0.703 |
0 |
0 |
0 |
0.000 |
43 |
54 |
|
D |
1 |
1 |
6536 |
◊ |
[SO4]G:202 |
x-1,y,z |
1_455 |
1 |
1 |
185 |
1.5 |
-0.2 |
0.815 |
0 |
0 |
0 |
0.000 |
44 |
55 |
|
[SO4]E:203 |
1 |
1 |
185 |
◊ |
H |
x-1,y,z |
1_455 |
1 |
1 |
6576 |
0.3 |
-0.0 |
0.791 |
0 |
0 |
0 |
0.000 |
|