## |
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 |
|
U |
128 |
29 |
6234 |
◊ |
D |
x,y,z |
1_555 |
136 |
29 |
6415 |
1450.2 |
-17.2 |
0.251 |
19 |
5 |
0 |
1.000 |
2 |
|
K |
142 |
29 |
6221 |
◊ |
H |
x,y,z |
1_555 |
136 |
30 |
6263 |
1434.7 |
-15.4 |
0.310 |
19 |
6 |
0 |
1.000 |
Average: |
1442.4 |
-16.3 |
0.281 |
19 |
6 |
0 |
1.000 |
2 |
3 |
|
H |
127 |
25 |
6263 |
◊ |
G |
x,y,z |
1_555 |
152 |
40 |
7728 |
1397.9 |
-8.3 |
0.392 |
25 |
18 |
0 |
1.000 |
4 |
|
D |
118 |
25 |
6415 |
◊ |
C |
x,y,z |
1_555 |
141 |
37 |
7849 |
1299.6 |
-11.6 |
0.264 |
22 |
18 |
0 |
1.000 |
Average: |
1348.7 |
-10.0 |
0.328 |
24 |
18 |
0 |
1.000 |
3 |
5 |
|
U |
111 |
23 |
6234 |
◊ |
E |
x,y,z |
1_555 |
134 |
37 |
7185 |
1217.8 |
-10.0 |
0.334 |
24 |
18 |
0 |
0.665 |
4 |
6 |
|
C |
127 |
30 |
7849 |
◊ |
A |
x,y,z |
1_555 |
127 |
32 |
7130 |
1214.8 |
-7.5 |
0.333 |
26 |
16 |
0 |
1.000 |
7 |
|
G |
128 |
30 |
7728 |
◊ |
E |
x,y,z |
1_555 |
124 |
33 |
7185 |
1208.6 |
-8.4 |
0.293 |
21 |
9 |
0 |
1.000 |
Average: |
1211.7 |
-8.0 |
0.313 |
24 |
13 |
0 |
1.000 |
5 |
8 |
|
K |
105 |
22 |
6221 |
◊ |
A |
x,y,z |
1_555 |
126 |
37 |
7130 |
1186.2 |
-11.8 |
0.216 |
22 |
18 |
0 |
0.977 |
6 |
9 |
|
U |
52 |
14 |
6234 |
◊ |
C |
x,y,z |
1_555 |
53 |
17 |
7849 |
513.1 |
-3.0 |
0.479 |
6 |
0 |
0 |
0.048 |
7 |
10 |
|
K |
50 |
13 |
6221 |
◊ |
G |
x,y,z |
1_555 |
45 |
15 |
7728 |
458.2 |
-1.3 |
0.546 |
5 |
0 |
0 |
0.046 |
8 |
11 |
|
E |
39 |
9 |
7185 |
◊ |
C |
x,y,z |
1_555 |
49 |
16 |
7849 |
383.3 |
-2.1 |
0.359 |
3 |
4 |
0 |
0.045 |
12 |
|
G |
49 |
16 |
7728 |
◊ |
A |
x,y,z |
1_555 |
36 |
8 |
7130 |
370.3 |
-2.9 |
0.272 |
1 |
1 |
0 |
0.045 |
Average: |
376.8 |
-2.5 |
0.315 |
2 |
3 |
0 |
0.045 |
9 |
13 |
|
A |
36 |
11 |
7130 |
◊ |
E |
-x,y-1/2,-z+1/2 |
3_545 |
37 |
9 |
7185 |
286.3 |
-1.9 |
0.430 |
3 |
4 |
0 |
0.000 |
10 |
14 |
|
D |
16 |
5 |
6415 |
◊ |
C |
x-1,y,z |
1_455 |
36 |
11 |
7849 |
220.1 |
0.0 |
0.648 |
3 |
0 |
0 |
0.000 |
11 |
15 |
|
K |
23 |
8 |
6221 |
◊ |
C |
-x-1/2,-y+1,z-1/2 |
2_464 |
22 |
8 |
7849 |
197.9 |
2.4 |
0.812 |
4 |
1 |
0 |
0.000 |
12 |
16 |
|
H |
20 |
6 |
6263 |
◊ |
G |
x-1,y,z |
1_455 |
22 |
4 |
7728 |
179.1 |
0.5 |
0.692 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
D |
20 |
7 |
6415 |
◊ |
E |
x-1,y,z |
1_455 |
22 |
6 |
7185 |
162.1 |
0.8 |
0.732 |
3 |
0 |
0 |
0.000 |
14 |
18 |
|
U |
19 |
6 |
6234 |
◊ |
C |
x-1/2,-y+3/2,-z+1 |
4_466 |
21 |
8 |
7849 |
160.3 |
-0.7 |
0.582 |
0 |
0 |
0 |
0.002 |
15 |
19 |
|
H |
15 |
8 |
6263 |
◊ |
E |
x,y,z |
1_555 |
19 |
8 |
7185 |
155.5 |
0.2 |
0.657 |
0 |
0 |
0 |
0.006 |
20 |
|
D |
12 |
4 |
6415 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
7130 |
123.3 |
-0.4 |
0.574 |
0 |
0 |
0 |
0.006 |
Average: |
139.4 |
-0.1 |
0.616 |
0 |
0 |
0 |
0.006 |
16 |
21 |
|
K |
20 |
6 |
6221 |
◊ |
D |
-x-1/2,-y+1,z-1/2 |
2_464 |
16 |
8 |
6415 |
149.2 |
-1.3 |
0.540 |
2 |
0 |
0 |
0.000 |
17 |
22 |
|
U |
16 |
5 |
6234 |
◊ |
G |
x,y,z |
1_555 |
13 |
5 |
7728 |
124.7 |
-0.4 |
0.582 |
1 |
1 |
0 |
0.018 |
18 |
23 |
|
K |
13 |
3 |
6221 |
◊ |
C |
x,y,z |
1_555 |
14 |
6 |
7849 |
116.8 |
-0.7 |
0.527 |
1 |
1 |
0 |
0.015 |
19 |
24 |
|
[1PE]A:201 |
9 |
1 |
483 |
◊ |
C |
x,y,z |
1_555 |
14 |
3 |
7849 |
110.6 |
-0.3 |
0.602 |
0 |
0 |
0 |
0.008 |
20 |
25 |
|
[1PE]A:201 |
8 |
1 |
483 |
◊ |
G |
x,y,z |
1_555 |
14 |
3 |
7728 |
106.3 |
1.4 |
0.774 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
U |
11 |
5 |
6234 |
◊ |
E |
x-1,y,z |
1_455 |
15 |
6 |
7185 |
104.9 |
-0.4 |
0.586 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
[1PE]A:201 |
8 |
1 |
483 |
◊ |
E |
x,y,z |
1_555 |
10 |
3 |
7185 |
96.2 |
-0.2 |
0.604 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
[1PE]A:201 |
8 |
1 |
483 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
7130 |
94.7 |
-0.6 |
0.561 |
0 |
0 |
0 |
0.100 |
24 |
29 |
|
U |
13 |
4 |
6234 |
x |
U |
x-1,y,z |
1_455 |
11 |
5 |
6234 |
91.6 |
-0.1 |
0.666 |
2 |
0 |
0 |
0.000 |
25 |
30 |
|
[SO4]U:101 |
5 |
1 |
186 |
f |
U |
x,y,z |
1_555 |
10 |
4 |
6234 |
78.0 |
-10.4 |
0.825 |
3 |
0 |
0 |
0.335 |
26 |
31 |
|
[SO4]C:201 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
7849 |
75.9 |
-11.9 |
0.645 |
3 |
0 |
0 |
0.372 |
27 |
32 |
|
D |
8 |
2 |
6415 |
◊ |
E |
x-1/2,-y+3/2,-z+1 |
4_466 |
10 |
4 |
7185 |
75.0 |
0.7 |
0.677 |
1 |
0 |
0 |
0.000 |
28 |
33 |
|
U |
8 |
2 |
6234 |
◊ |
C |
x-1,y,z |
1_455 |
10 |
4 |
7849 |
69.2 |
-0.5 |
0.521 |
0 |
0 |
0 |
0.000 |
29 |
34 |
|
[SO4]U:101 |
5 |
1 |
186 |
◊ |
C |
x-1/2,-y+3/2,-z+1 |
4_466 |
8 |
3 |
7849 |
68.2 |
-9.1 |
0.818 |
2 |
0 |
0 |
0.028 |
30 |
35 |
|
D |
11 |
4 |
6415 |
◊ |
U |
x-1,y,z |
1_455 |
12 |
6 |
6234 |
67.0 |
0.7 |
0.733 |
1 |
1 |
0 |
0.000 |
31 |
36 |
|
H |
8 |
4 |
6263 |
◊ |
D |
-x-1/2,-y+1,z-1/2 |
2_464 |
7 |
3 |
6415 |
65.6 |
0.2 |
0.682 |
1 |
0 |
0 |
0.000 |
32 |
37 |
|
[SO4]C:201 |
5 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
10 |
5 |
6415 |
63.8 |
-8.8 |
0.736 |
1 |
0 |
0 |
0.199 |
33 |
38 |
|
U |
8 |
5 |
6234 |
x |
U |
x-1/2,-y+3/2,-z+1 |
4_466 |
10 |
4 |
6234 |
63.7 |
-1.0 |
0.482 |
0 |
0 |
0 |
0.000 |
34 |
39 |
|
D |
12 |
6 |
6415 |
◊ |
C |
x-1/2,-y+3/2,-z+1 |
4_466 |
8 |
3 |
7849 |
60.7 |
-0.0 |
0.629 |
0 |
0 |
0 |
0.000 |
35 |
40 |
|
D |
8 |
3 |
6415 |
◊ |
G |
x-1,y,z |
1_455 |
8 |
2 |
7728 |
58.7 |
-0.1 |
0.551 |
0 |
0 |
0 |
0.000 |
36 |
41 |
|
U |
5 |
1 |
6234 |
◊ |
E |
x-1/2,-y+3/2,-z+1 |
4_466 |
6 |
1 |
7185 |
57.2 |
0.8 |
0.803 |
0 |
0 |
0 |
0.000 |
37 |
42 |
|
U |
4 |
2 |
6234 |
◊ |
H |
x,y,z |
1_555 |
6 |
4 |
6263 |
46.1 |
-0.0 |
0.555 |
0 |
0 |
0 |
0.000 |
38 |
43 |
|
K |
3 |
3 |
6221 |
◊ |
G |
x-1,y,z |
1_455 |
3 |
2 |
7728 |
35.0 |
-1.0 |
0.218 |
0 |
0 |
0 |
0.000 |
39 |
44 |
|
D |
1 |
1 |
6415 |
◊ |
U |
x-1/2,-y+3/2,-z+1 |
4_466 |
5 |
4 |
6234 |
34.3 |
0.3 |
0.742 |
0 |
0 |
0 |
0.000 |
40 |
45 |
|
G |
6 |
2 |
7728 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
7849 |
33.4 |
1.1 |
0.790 |
0 |
0 |
0 |
0.000 |
41 |
46 |
|
K |
3 |
3 |
6221 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
6415 |
27.6 |
0.2 |
0.666 |
0 |
0 |
0 |
0.000 |
42 |
47 |
|
E |
2 |
2 |
7185 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
7130 |
24.3 |
0.2 |
0.719 |
0 |
0 |
0 |
0.000 |
43 |
48 |
|
C |
2 |
2 |
7849 |
◊ |
E |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
7185 |
12.7 |
0.2 |
0.766 |
0 |
0 |
0 |
0.000 |
44 |
49 |
|
K |
2 |
1 |
6221 |
◊ |
[SO4]C:201 |
-x-1/2,-y+1,z-1/2 |
2_464 |
3 |
1 |
186 |
11.4 |
-0.9 |
0.899 |
0 |
0 |
0 |
0.000 |
45 |
50 |
|
A |
3 |
1 |
7130 |
◊ |
G |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
2 |
7728 |
8.9 |
-0.0 |
0.582 |
0 |
0 |
0 |
0.000 |
46 |
51 |
|
H |
2 |
1 |
6263 |
◊ |
C |
-x-1/2,-y+1,z-1/2 |
2_464 |
2 |
1 |
7849 |
0.9 |
0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
|