## |
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 |
|
D |
75 |
20 |
11890 |
◊ |
C |
x,y,z |
1_555 |
75 |
20 |
11648 |
673.1 |
-3.9 |
0.296 |
9 |
4 |
0 |
0.000 |
2 |
|
B |
74 |
19 |
11685 |
◊ |
A |
x,y,z |
1_555 |
76 |
19 |
11561 |
630.9 |
-2.5 |
0.406 |
7 |
5 |
0 |
0.000 |
Average: |
652.0 |
-3.2 |
0.351 |
8 |
5 |
0 |
0.000 |
2 |
3 |
|
D |
73 |
23 |
11890 |
x |
D |
-x,y-1/2,-z+1 |
2_546 |
72 |
20 |
11890 |
653.6 |
-5.7 |
0.133 |
4 |
3 |
0 |
0.000 |
4 |
|
B |
62 |
20 |
11685 |
x |
B |
-x-1,y-1/2,-z |
2_445 |
67 |
21 |
11685 |
609.5 |
-3.6 |
0.280 |
8 |
4 |
0 |
0.000 |
Average: |
631.6 |
-4.7 |
0.207 |
6 |
4 |
0 |
0.000 |
3 |
5 |
|
A |
46 |
17 |
11561 |
◊ |
C |
x,y,z-1 |
1_554 |
46 |
13 |
11648 |
391.6 |
-3.2 |
0.268 |
1 |
1 |
0 |
0.000 |
4 |
6 |
|
B |
42 |
13 |
11685 |
◊ |
C |
x,y,z-1 |
1_554 |
42 |
13 |
11648 |
366.6 |
-0.7 |
0.374 |
2 |
3 |
0 |
0.000 |
5 |
7 |
|
A |
26 |
7 |
11561 |
x |
A |
-x,y-1/2,-z |
2_545 |
33 |
11 |
11561 |
278.7 |
2.7 |
0.778 |
6 |
4 |
0 |
0.000 |
6 |
8 |
|
A |
32 |
10 |
11561 |
◊ |
B |
-x-1,y-1/2,-z |
2_445 |
23 |
6 |
11685 |
223.8 |
-4.1 |
0.117 |
0 |
0 |
0 |
0.000 |
9 |
|
C |
36 |
11 |
11648 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
20 |
7 |
11890 |
218.6 |
3.0 |
0.822 |
3 |
1 |
0 |
0.000 |
Average: |
221.2 |
-0.6 |
0.470 |
2 |
1 |
0 |
0.000 |
7 |
10 |
|
A |
21 |
6 |
11561 |
◊ |
D |
x,y,z-1 |
1_554 |
25 |
9 |
11890 |
179.4 |
-0.5 |
0.503 |
2 |
1 |
0 |
0.000 |
8 |
11 |
|
[SO4]D:9002 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
17 |
9 |
11890 |
106.7 |
-17.3 |
0.686 |
9 |
0 |
0 |
0.100 |
12 |
|
[SO4]A:9003 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
11561 |
106.5 |
-16.6 |
0.691 |
7 |
0 |
0 |
0.100 |
Average: |
106.6 |
-16.9 |
0.688 |
8 |
0 |
0 |
0.100 |
9 |
13 |
|
[SO4]B:9001 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
11685 |
105.8 |
-17.4 |
0.674 |
9 |
0 |
0 |
0.057 |
10 |
14 |
|
[SO4]C:9004 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
18 |
8 |
11648 |
103.2 |
-16.8 |
0.652 |
7 |
0 |
0 |
0.100 |
11 |
15 |
|
[SO4]D:9005 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
14 |
4 |
11890 |
91.4 |
-14.1 |
0.745 |
7 |
0 |
0 |
0.045 |
12 |
16 |
|
[SO4]B:9006 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
3 |
11685 |
87.7 |
-13.6 |
0.726 |
5 |
0 |
0 |
0.043 |
13 |
17 |
|
C |
7 |
2 |
11648 |
x |
C |
-x-1,y-1/2,-z+1 |
2_446 |
10 |
4 |
11648 |
77.5 |
-0.7 |
0.339 |
0 |
0 |
0 |
0.000 |
14 |
18 |
|
B |
11 |
6 |
11685 |
◊ |
A |
x-1,y,z |
1_455 |
10 |
6 |
11561 |
70.9 |
1.8 |
0.834 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
C |
7 |
2 |
11648 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
11685 |
64.4 |
-0.3 |
0.494 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
D |
10 |
4 |
11890 |
◊ |
A |
x,y,z |
1_555 |
9 |
6 |
11561 |
61.9 |
0.9 |
0.735 |
1 |
2 |
0 |
0.000 |
17 |
21 |
|
B |
7 |
3 |
11685 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
6 |
2 |
11561 |
59.8 |
0.7 |
0.744 |
1 |
0 |
0 |
0.000 |
22 |
|
D |
4 |
2 |
11890 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
3 |
2 |
11648 |
31.4 |
0.9 |
0.838 |
1 |
0 |
0 |
0.000 |
Average: |
45.6 |
0.8 |
0.791 |
1 |
0 |
0 |
0.000 |
18 |
23 |
|
C |
3 |
1 |
11648 |
◊ |
D |
x-1,y,z |
1_455 |
6 |
2 |
11890 |
33.7 |
1.0 |
0.771 |
1 |
0 |
0 |
0.000 |
19 |
24 |
|
B |
4 |
2 |
11685 |
◊ |
D |
x-1,y,z-1 |
1_454 |
5 |
3 |
11890 |
24.0 |
0.7 |
0.782 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
C |
1 |
1 |
11648 |
◊ |
B |
-x-1,y-1/2,-z+1 |
2_446 |
1 |
1 |
11685 |
22.1 |
0.1 |
0.284 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
C |
3 |
2 |
11648 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
11561 |
15.8 |
-0.2 |
0.433 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
A |
1 |
1 |
11561 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
4 |
1 |
11890 |
15.4 |
-0.3 |
0.268 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
B |
3 |
2 |
11685 |
◊ |
C |
-x-1,y-1/2,-z+1 |
2_446 |
2 |
2 |
11648 |
9.3 |
0.1 |
0.658 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
C |
1 |
1 |
11648 |
◊ |
[SO4]B:9006 |
-x-1,y-1/2,-z+1 |
2_446 |
1 |
1 |
185 |
6.2 |
-0.5 |
0.841 |
0 |
0 |
0 |
0.000 |
|