## |
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 |
|
B |
91 |
23 |
5856 |
◊ |
A |
x,y,z |
1_555 |
92 |
23 |
5856 |
838.8 |
-0.9 |
0.626 |
24 |
18 |
0 |
0.285 |
2 |
|
D |
83 |
20 |
5588 |
◊ |
C |
x,y,z |
1_555 |
90 |
21 |
5897 |
816.4 |
-2.4 |
0.514 |
22 |
14 |
0 |
0.285 |
Average: |
827.6 |
-1.6 |
0.570 |
23 |
16 |
0 |
0.285 |
2 |
3 |
|
C |
37 |
11 |
5897 |
◊ |
A |
x,y,z |
1_555 |
40 |
10 |
5856 |
392.3 |
-5.1 |
0.179 |
2 |
4 |
0 |
0.100 |
4 |
|
D |
34 |
11 |
5588 |
◊ |
B |
x,y,z |
1_555 |
37 |
12 |
5856 |
370.0 |
-4.6 |
0.197 |
4 |
4 |
0 |
0.100 |
Average: |
381.2 |
-4.9 |
0.188 |
3 |
4 |
0 |
0.100 |
3 |
5 |
|
B |
40 |
12 |
5856 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
49 |
12 |
5897 |
376.2 |
-0.1 |
0.586 |
10 |
4 |
0 |
0.000 |
4 |
6 |
|
B |
38 |
9 |
5856 |
◊ |
C |
-x-1,y-1/2,-z-1/2 |
3_444 |
35 |
12 |
5897 |
345.8 |
-1.9 |
0.374 |
5 |
0 |
0 |
0.000 |
5 |
7 |
|
B |
28 |
11 |
5856 |
◊ |
D |
-x-1/2,-y,z-1/2 |
2_454 |
33 |
11 |
5588 |
291.7 |
-4.3 |
0.202 |
3 |
0 |
0 |
0.000 |
6 |
8 |
|
A |
29 |
8 |
5856 |
x |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
35 |
11 |
5856 |
258.1 |
-2.1 |
0.430 |
1 |
0 |
0 |
0.000 |
7 |
9 |
|
D |
19 |
9 |
5588 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
21 |
8 |
5897 |
196.5 |
1.5 |
0.676 |
3 |
0 |
0 |
0.000 |
8 |
10 |
|
C |
19 |
7 |
5897 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
18 |
6 |
5856 |
186.7 |
-3.0 |
0.197 |
2 |
0 |
0 |
0.000 |
9 |
11 |
|
B |
18 |
5 |
5856 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
18 |
7 |
5856 |
157.9 |
1.6 |
0.683 |
3 |
0 |
0 |
0.000 |
10 |
12 |
|
A |
16 |
8 |
5856 |
◊ |
C |
-x-1,y-1/2,-z-1/2 |
3_444 |
17 |
8 |
5897 |
104.1 |
1.9 |
0.722 |
1 |
0 |
0 |
0.000 |
11 |
13 |
|
[SO4]D:201 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
5588 |
82.5 |
-11.0 |
0.797 |
3 |
0 |
0 |
0.247 |
12 |
14 |
|
[SO4]A:201 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
5856 |
80.2 |
-10.4 |
0.914 |
3 |
0 |
0 |
0.164 |
13 |
15 |
|
[SO4]B:201 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
5856 |
79.9 |
-10.6 |
0.819 |
3 |
0 |
0 |
0.166 |
14 |
16 |
|
[SO4]B:202 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
5856 |
78.3 |
-9.7 |
0.915 |
4 |
0 |
0 |
0.160 |
15 |
17 |
|
D |
12 |
6 |
5588 |
◊ |
A |
x,y,z |
1_555 |
11 |
6 |
5856 |
77.8 |
-0.9 |
0.451 |
0 |
0 |
0 |
0.007 |
18 |
|
C |
10 |
6 |
5897 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
5856 |
61.3 |
-0.0 |
0.592 |
0 |
0 |
0 |
0.007 |
Average: |
69.6 |
-0.5 |
0.522 |
0 |
0 |
0 |
0.007 |
16 |
19 |
|
[SO4]D:202 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
5588 |
77.7 |
-11.1 |
0.857 |
4 |
0 |
0 |
0.258 |
17 |
20 |
|
[SO4]A:201 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
5856 |
70.0 |
-9.7 |
0.838 |
4 |
0 |
0 |
0.160 |
18 |
21 |
|
[SO4]B:201 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
5856 |
69.6 |
-9.4 |
0.861 |
3 |
0 |
0 |
0.150 |
19 |
22 |
|
[SO4]D:201 |
5 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
5897 |
68.1 |
-9.2 |
0.842 |
3 |
0 |
0 |
0.210 |
20 |
23 |
|
D |
9 |
5 |
5588 |
x |
D |
-x,y-1/2,-z-1/2 |
3_544 |
7 |
3 |
5588 |
64.9 |
0.3 |
0.596 |
1 |
0 |
0 |
0.000 |
21 |
24 |
|
B |
10 |
5 |
5856 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
9 |
3 |
5588 |
55.9 |
1.2 |
0.764 |
1 |
0 |
0 |
0.000 |
22 |
25 |
|
C |
1 |
1 |
5897 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
5588 |
4.2 |
-0.0 |
0.526 |
0 |
0 |
0 |
0.000 |
|