## |
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 |
82 |
27 |
14076 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
89 |
25 |
13818 |
871.4 |
-5.6 |
0.380 |
10 |
4 |
0 |
0.000 |
2 |
|
B |
73 |
22 |
13549 |
◊ |
D |
-x+1/2,y-1/2,-z+1 |
4_546 |
74 |
24 |
13985 |
777.1 |
-4.1 |
0.411 |
12 |
6 |
0 |
0.000 |
Average: |
824.2 |
-4.8 |
0.395 |
11 |
5 |
0 |
0.000 |
2 |
3 |
|
C |
68 |
20 |
14076 |
◊ |
B |
x,y,z |
1_555 |
72 |
20 |
13549 |
610.0 |
-5.9 |
0.262 |
6 |
0 |
0 |
0.000 |
4 |
|
D |
68 |
19 |
13985 |
◊ |
A |
x,y,z |
1_555 |
67 |
19 |
13818 |
607.0 |
-6.5 |
0.248 |
6 |
0 |
0 |
0.000 |
Average: |
608.5 |
-6.2 |
0.255 |
6 |
0 |
0 |
0.000 |
3 |
5 |
|
D |
58 |
20 |
13985 |
◊ |
B |
x,y,z |
1_555 |
51 |
17 |
13549 |
512.7 |
-1.9 |
0.505 |
7 |
4 |
0 |
0.000 |
6 |
|
C |
51 |
19 |
14076 |
◊ |
A |
x,y,z |
1_555 |
51 |
17 |
13818 |
458.0 |
-3.8 |
0.342 |
4 |
2 |
0 |
0.000 |
Average: |
485.4 |
-2.9 |
0.423 |
6 |
3 |
0 |
0.000 |
4 |
7 |
|
B |
50 |
13 |
13549 |
◊ |
A |
-x,y,-z |
2_555 |
49 |
14 |
13818 |
458.3 |
0.1 |
0.688 |
5 |
0 |
0 |
0.000 |
8 |
|
D |
48 |
13 |
13985 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
50 |
13 |
14076 |
420.1 |
1.6 |
0.794 |
5 |
0 |
0 |
0.000 |
Average: |
439.2 |
0.8 |
0.741 |
5 |
0 |
0 |
0.000 |
5 |
9 |
|
[6R0]D:502 |
32 |
1 |
684 |
f |
D |
x,y,z |
1_555 |
61 |
26 |
13985 |
435.8 |
3.4 |
0.293 |
2 |
0 |
0 |
0.000 |
10 |
|
[6R0]C:501 |
31 |
1 |
676 |
f |
C |
x,y,z |
1_555 |
57 |
24 |
14076 |
428.5 |
3.3 |
0.308 |
1 |
0 |
0 |
0.000 |
11 |
|
[6R0]B:503 |
31 |
1 |
681 |
f |
B |
x,y,z |
1_555 |
55 |
23 |
13549 |
427.1 |
3.5 |
0.265 |
2 |
0 |
0 |
0.000 |
12 |
|
[6R0]A:503 |
31 |
1 |
681 |
f |
A |
x,y,z |
1_555 |
56 |
24 |
13818 |
426.4 |
3.4 |
0.264 |
1 |
0 |
0 |
0.000 |
Average: |
429.5 |
3.4 |
0.283 |
2 |
0 |
0 |
0.000 |
6 |
13 |
|
D |
27 |
8 |
13985 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
27 |
8 |
13985 |
231.0 |
4.1 |
0.944 |
6 |
0 |
0 |
0.000 |
7 |
14 |
|
D |
29 |
10 |
13985 |
◊ |
C |
x,y,z |
1_555 |
25 |
10 |
14076 |
227.4 |
-3.1 |
0.274 |
0 |
0 |
0 |
0.000 |
8 |
15 |
|
B |
18 |
6 |
13549 |
◊ |
B |
-x,y,-z+1 |
2_556 |
18 |
6 |
13549 |
168.1 |
-1.8 |
0.330 |
0 |
0 |
0 |
0.000 |
9 |
16 |
|
C |
14 |
6 |
14076 |
◊ |
B |
-x+1,y,-z+1 |
2_656 |
17 |
6 |
13549 |
131.8 |
-0.1 |
0.552 |
3 |
1 |
0 |
0.000 |
10 |
17 |
|
C |
15 |
5 |
14076 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
15 |
5 |
14076 |
107.6 |
1.8 |
0.851 |
2 |
4 |
0 |
0.000 |
11 |
18 |
|
[SO4]A:501 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
13818 |
102.1 |
-12.4 |
0.845 |
3 |
0 |
0 |
0.043 |
12 |
19 |
|
[SO4]A:502 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
13818 |
80.3 |
-9.7 |
0.954 |
3 |
0 |
0 |
0.034 |
13 |
20 |
|
[SO4]B:502 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
13549 |
73.5 |
-9.0 |
0.941 |
3 |
0 |
0 |
0.134 |
14 |
21 |
|
A |
12 |
4 |
13818 |
f |
[SO4]B:501 |
x,y,z-1 |
1_554 |
5 |
1 |
186 |
72.7 |
-10.0 |
0.723 |
1 |
0 |
0 |
0.032 |
15 |
22 |
|
[SO4]D:501 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
13985 |
68.4 |
-9.6 |
0.715 |
1 |
0 |
0 |
0.133 |
16 |
23 |
|
[SO4]B:501 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
13549 |
60.0 |
-8.1 |
0.683 |
1 |
0 |
0 |
0.000 |
17 |
24 |
|
D |
8 |
5 |
13985 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
5 |
3 |
13818 |
58.8 |
-0.5 |
0.433 |
0 |
0 |
0 |
0.000 |
18 |
25 |
|
D |
7 |
3 |
13985 |
◊ |
A |
-x,y,-z |
2_555 |
6 |
3 |
13818 |
54.4 |
1.0 |
0.800 |
1 |
0 |
0 |
0.000 |
19 |
26 |
|
A |
1 |
1 |
13818 |
◊ |
B |
x,y,z-1 |
1_554 |
3 |
1 |
13549 |
15.9 |
-0.1 |
0.541 |
0 |
0 |
0 |
0.000 |
20 |
27 |
|
A |
1 |
1 |
13818 |
◊ |
D |
x,y,z-1 |
1_554 |
2 |
1 |
13985 |
11.5 |
-0.1 |
0.375 |
0 |
0 |
0 |
0.000 |
28 |
|
C |
2 |
1 |
14076 |
◊ |
B |
x,y,z-1 |
1_554 |
1 |
1 |
13549 |
7.8 |
-0.0 |
0.434 |
0 |
0 |
0 |
0.000 |
Average: |
9.7 |
-0.1 |
0.404 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[SO4]D:501 |
1 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
13549 |
9.6 |
-1.0 |
0.812 |
0 |
0 |
0 |
0.000 |
22 |
30 |
|
[SO4]B:502 |
1 |
1 |
185 |
◊ |
D |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
13985 |
0.2 |
-0.0 |
0.814 |
0 |
0 |
0 |
0.000 |
|