## |
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 |
120 |
35 |
6797 |
◊ |
C |
-y,-x,-z+1/2 |
8_555 |
121 |
36 |
6797 |
1270.5 |
-18.0 |
0.112 |
15 |
4 |
0 |
1.000 |
2 |
|
B |
127 |
36 |
6771 |
◊ |
A |
x,y,z |
1_555 |
118 |
36 |
6847 |
1252.8 |
-18.7 |
0.074 |
15 |
4 |
0 |
1.000 |
3 |
|
D |
119 |
36 |
6738 |
◊ |
D |
y,x,-z+1 |
7_556 |
121 |
36 |
6738 |
1231.1 |
-18.9 |
0.065 |
15 |
4 |
0 |
1.000 |
Average: |
1251.5 |
-18.5 |
0.083 |
15 |
4 |
0 |
1.000 |
2 |
4 |
|
D |
49 |
14 |
6738 |
◊ |
C |
x,y,z |
1_555 |
51 |
13 |
6797 |
400.5 |
-2.6 |
0.572 |
6 |
2 |
0 |
0.000 |
5 |
|
A |
47 |
13 |
6847 |
◊ |
B |
-y+1/2,x+1/2,z+1/4 |
3_555 |
50 |
14 |
6771 |
396.6 |
-2.9 |
0.528 |
5 |
1 |
0 |
0.000 |
Average: |
398.5 |
-2.8 |
0.550 |
6 |
2 |
0 |
0.000 |
3 |
6 |
|
A |
28 |
9 |
6847 |
◊ |
D |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
31 |
8 |
6738 |
248.9 |
-1.0 |
0.617 |
1 |
0 |
0 |
0.000 |
7 |
|
C |
29 |
9 |
6797 |
◊ |
B |
-y,-x,-z+1/2 |
8_555 |
30 |
8 |
6771 |
247.0 |
-1.2 |
0.640 |
2 |
0 |
0 |
0.000 |
Average: |
248.0 |
-1.1 |
0.628 |
2 |
0 |
0 |
0.000 |
4 |
8 |
|
D |
31 |
10 |
6738 |
◊ |
A |
-y+1/2,x-1/2,z+1/4 |
3_545 |
27 |
7 |
6847 |
246.9 |
0.6 |
0.772 |
5 |
2 |
0 |
0.000 |
9 |
|
A |
30 |
10 |
6847 |
◊ |
C |
-y,-x+1,-z+1/2 |
8_565 |
26 |
7 |
6797 |
242.0 |
0.6 |
0.762 |
4 |
2 |
0 |
0.000 |
Average: |
244.5 |
0.6 |
0.767 |
5 |
2 |
0 |
0.000 |
5 |
10 |
|
B |
17 |
5 |
6771 |
◊ |
C |
-y,-x+1,-z+1/2 |
8_565 |
24 |
8 |
6797 |
175.2 |
-1.0 |
0.575 |
2 |
0 |
0 |
0.000 |
11 |
|
D |
16 |
5 |
6738 |
◊ |
A |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
22 |
7 |
6847 |
170.5 |
-1.1 |
0.509 |
2 |
0 |
0 |
0.000 |
Average: |
172.9 |
-1.1 |
0.542 |
2 |
0 |
0 |
0.000 |
6 |
12 |
|
[SO4]B:201 |
5 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
6771 |
77.7 |
-11.1 |
0.850 |
4 |
0 |
0 |
0.297 |
7 |
13 |
|
[SO4]C:201 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
6797 |
76.6 |
-11.2 |
0.783 |
4 |
0 |
0 |
0.355 |
8 |
14 |
|
B |
11 |
7 |
6771 |
◊ |
D |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
10 |
5 |
6738 |
71.2 |
1.3 |
0.864 |
1 |
2 |
0 |
0.000 |
15 |
|
C |
12 |
7 |
6797 |
◊ |
B |
x,y,z |
1_555 |
10 |
6 |
6771 |
60.6 |
0.4 |
0.737 |
0 |
0 |
0 |
0.000 |
Average: |
65.9 |
0.9 |
0.800 |
1 |
1 |
0 |
0.000 |
9 |
16 |
|
[SO4]B:202 |
4 |
1 |
185 |
f |
C |
-y,-x,-z+1/2 |
8_555 |
8 |
3 |
6797 |
47.5 |
-4.7 |
0.950 |
3 |
0 |
0 |
0.163 |
10 |
17 |
|
C |
2 |
2 |
6797 |
◊ |
B |
-y+1/2,x-1/2,z+1/4 |
3_545 |
5 |
2 |
6771 |
42.6 |
1.2 |
0.922 |
1 |
0 |
0 |
0.000 |
11 |
18 |
|
[SO4]B:202 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
6771 |
42.5 |
-4.8 |
0.889 |
1 |
0 |
0 |
0.000 |
12 |
19 |
|
[SO4]B:201 |
2 |
1 |
183 |
◊ |
D |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
9 |
4 |
6738 |
41.2 |
-5.2 |
0.849 |
0 |
0 |
0 |
0.000 |
13 |
20 |
|
[SO4]C:201 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
6771 |
37.8 |
-4.8 |
0.852 |
0 |
0 |
0 |
0.000 |
14 |
21 |
|
[SO4]C:201 |
3 |
1 |
185 |
◊ |
C |
-y,-x,-z+1/2 |
8_555 |
2 |
1 |
6797 |
36.1 |
-3.2 |
0.977 |
2 |
0 |
0 |
0.112 |
15 |
22 |
|
[SO4]B:201 |
3 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
6847 |
35.5 |
-3.3 |
0.965 |
3 |
0 |
0 |
0.107 |
16 |
23 |
|
C |
4 |
2 |
6797 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
6847 |
10.5 |
-0.3 |
0.445 |
0 |
0 |
0 |
0.000 |
24 |
|
D |
2 |
2 |
6738 |
◊ |
B |
-y+1/2,x+1/2,z+1/4 |
3_555 |
3 |
2 |
6771 |
10.3 |
-0.2 |
0.475 |
0 |
0 |
0 |
0.000 |
Average: |
10.4 |
-0.3 |
0.460 |
0 |
0 |
0 |
0.000 |
17 |
25 |
|
[SO4]B:202 |
1 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
6797 |
7.0 |
-0.9 |
0.488 |
0 |
0 |
0 |
0.026 |
18 |
26 |
|
D |
1 |
1 |
6738 |
◊ |
B |
-y+1/2,x-1/2,z+1/4 |
3_545 |
1 |
1 |
6771 |
1.1 |
-0.0 |
0.600 |
0 |
0 |
0 |
0.000 |
27 |
|
C |
1 |
1 |
6797 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
6847 |
0.9 |
-0.0 |
0.619 |
0 |
0 |
0 |
0.000 |
Average: |
1.0 |
-0.0 |
0.610 |
0 |
0 |
0 |
0.000 |
|