## |
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 |
|
A |
68 |
21 |
16022 |
◊ |
B |
x-1,y,z |
1_455 |
71 |
21 |
16080 |
665.0 |
-5.2 |
0.103 |
6 |
0 |
0 |
0.029 |
2 |
2 |
|
B |
54 |
16 |
16080 |
x |
B |
x-1,y,z |
1_455 |
70 |
22 |
16080 |
565.4 |
-0.1 |
0.394 |
4 |
1 |
0 |
0.000 |
3 |
|
A |
70 |
17 |
16022 |
x |
A |
x-1,y,z |
1_455 |
58 |
17 |
16022 |
534.3 |
0.5 |
0.384 |
4 |
2 |
0 |
0.000 |
Average: |
549.8 |
0.2 |
0.389 |
4 |
2 |
0 |
0.000 |
3 |
4 |
|
A |
54 |
16 |
16022 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
42 |
13 |
16080 |
456.9 |
3.2 |
0.695 |
6 |
0 |
0 |
0.000 |
4 |
5 |
|
A |
43 |
13 |
16022 |
◊ |
B |
-x-1/2,-y+1,z-1/2 |
2_464 |
50 |
15 |
16080 |
443.4 |
3.3 |
0.702 |
6 |
0 |
0 |
0.000 |
5 |
6 |
|
A |
12 |
4 |
16022 |
x |
A |
x-1/2,-y+1/2,-z+1 |
3_456 |
13 |
7 |
16022 |
157.9 |
-2.3 |
0.118 |
0 |
0 |
0 |
0.000 |
6 |
7 |
|
A |
14 |
4 |
16022 |
x |
A |
x-1/2,-y+3/2,-z+1 |
3_466 |
13 |
4 |
16022 |
132.4 |
1.2 |
0.666 |
4 |
0 |
0 |
0.000 |
7 |
8 |
|
[SO4]A:402 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
16022 |
107.5 |
-16.7 |
0.662 |
6 |
0 |
0 |
0.073 |
8 |
9 |
|
[SO4]B:402 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
16080 |
105.5 |
-16.6 |
0.708 |
4 |
0 |
0 |
0.069 |
9 |
10 |
|
[SO4]A:405 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
9 |
16022 |
93.5 |
-14.3 |
0.476 |
2 |
0 |
0 |
0.057 |
10 |
11 |
|
B |
8 |
3 |
16080 |
x |
B |
-x,y-1/2,-z+3/2 |
4_546 |
14 |
6 |
16080 |
89.6 |
0.6 |
0.620 |
1 |
0 |
0 |
0.000 |
11 |
12 |
|
[SO4]B:403 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
16080 |
87.1 |
-12.0 |
0.731 |
4 |
0 |
0 |
0.052 |
12 |
13 |
|
[CL]A:401 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
16022 |
85.9 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.091 |
14 |
|
[CL]B:401 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
16080 |
83.6 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.091 |
Average: |
84.8 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.091 |
13 |
15 |
|
[SO4]A:407 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
16022 |
85.2 |
-12.5 |
0.669 |
4 |
0 |
0 |
0.054 |
14 |
16 |
|
[SO4]A:410 |
5 |
1 |
185 |
f |
B |
x-1,y,z |
1_455 |
14 |
6 |
16080 |
80.1 |
-10.4 |
0.765 |
5 |
0 |
0 |
0.048 |
15 |
17 |
|
B |
6 |
4 |
16080 |
◊ |
A |
-x,y-1/2,-z+3/2 |
4_546 |
10 |
4 |
16022 |
79.5 |
0.6 |
0.565 |
0 |
0 |
0 |
0.000 |
16 |
18 |
|
[SO4]A:409 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
16022 |
72.9 |
-9.6 |
0.700 |
4 |
0 |
0 |
0.043 |
17 |
19 |
|
[SO4]A:403 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
16022 |
72.6 |
-10.0 |
0.670 |
2 |
0 |
0 |
0.041 |
18 |
20 |
|
B |
11 |
6 |
16080 |
x |
B |
-x+1,y-1/2,-z+3/2 |
4_646 |
8 |
3 |
16080 |
71.1 |
-0.7 |
0.338 |
1 |
0 |
0 |
0.000 |
19 |
21 |
|
[SO4]A:410 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
16022 |
70.8 |
-10.0 |
0.679 |
5 |
0 |
0 |
0.046 |
20 |
22 |
|
[SO4]B:406 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
16080 |
69.2 |
-9.0 |
0.715 |
3 |
0 |
0 |
0.039 |
21 |
23 |
|
[SO4]B:407 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
16080 |
69.0 |
-9.5 |
0.635 |
3 |
0 |
0 |
0.041 |
22 |
24 |
|
B |
11 |
3 |
16080 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
16022 |
68.2 |
1.5 |
0.751 |
1 |
0 |
0 |
0.000 |
23 |
25 |
|
[SO4]A:408 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
16022 |
66.0 |
-8.2 |
0.768 |
2 |
0 |
0 |
0.034 |
24 |
26 |
|
[SO4]B:404 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
16080 |
65.4 |
-8.4 |
0.803 |
2 |
0 |
0 |
0.035 |
25 |
27 |
|
[SO4]B:405 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
16080 |
64.0 |
-8.5 |
0.808 |
1 |
0 |
0 |
0.034 |
26 |
28 |
|
[SO4]A:413 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
16022 |
63.6 |
-9.2 |
0.537 |
0 |
0 |
0 |
0.035 |
27 |
29 |
|
[SO4]B:408 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
16080 |
63.5 |
-8.4 |
0.606 |
1 |
0 |
0 |
0.033 |
28 |
30 |
|
[SO4]A:406 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
16022 |
62.4 |
-8.3 |
0.573 |
2 |
0 |
0 |
0.035 |
29 |
31 |
|
[SO4]A:411 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
16022 |
59.8 |
-8.2 |
0.552 |
1 |
0 |
0 |
0.033 |
30 |
32 |
|
[SO4]A:404 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
16022 |
58.8 |
-7.6 |
0.628 |
3 |
0 |
0 |
0.034 |
31 |
33 |
|
[SO4]A:412 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
16022 |
56.7 |
-7.1 |
0.803 |
2 |
0 |
0 |
0.030 |
32 |
34 |
|
[SO4]A:409 |
4 |
1 |
184 |
◊ |
B |
-x-1/2,-y+1,z-1/2 |
2_464 |
7 |
3 |
16080 |
54.1 |
-5.5 |
0.886 |
2 |
0 |
0 |
0.000 |
33 |
35 |
|
[SO4]A:405 |
4 |
1 |
184 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
2 |
16022 |
37.6 |
-3.7 |
0.926 |
2 |
0 |
0 |
0.000 |
34 |
36 |
|
[SO4]A:404 |
3 |
1 |
185 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
1 |
16022 |
34.4 |
-3.9 |
0.835 |
1 |
0 |
0 |
0.000 |
35 |
37 |
|
[SO4]A:406 |
3 |
1 |
186 |
◊ |
A |
x-1/2,-y+3/2,-z+1 |
3_466 |
4 |
2 |
16022 |
31.0 |
-3.7 |
0.746 |
0 |
0 |
0 |
0.000 |
36 |
38 |
|
[SO4]A:406 |
3 |
1 |
186 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
1 |
16022 |
29.9 |
-3.7 |
0.725 |
0 |
0 |
0 |
0.000 |
37 |
39 |
|
[SO4]A:405 |
1 |
1 |
184 |
f |
[SO4]A:404 |
x,y,z |
1_555 |
1 |
1 |
185 |
13.0 |
-3.1 |
0.800 |
0 |
0 |
0 |
0.012 |
38 |
40 |
|
[SO4]A:411 |
3 |
1 |
185 |
◊ |
B |
-x-1/2,-y+1,z-1/2 |
2_464 |
1 |
1 |
16080 |
9.7 |
-1.1 |
0.886 |
0 |
0 |
0 |
0.000 |
39 |
41 |
|
A |
1 |
1 |
16022 |
◊ |
[SO4]B:407 |
-x-1/2,-y+1,z-1/2 |
2_464 |
3 |
1 |
184 |
5.5 |
-0.5 |
0.524 |
0 |
0 |
0 |
0.000 |
40 |
42 |
|
[SO4]A:413 |
1 |
1 |
186 |
f |
[SO4]A:406 |
x,y,z |
1_555 |
1 |
1 |
186 |
3.8 |
-0.9 |
1.000 |
0 |
0 |
0 |
0.003 |
41 |
43 |
|
B |
1 |
1 |
16080 |
◊ |
[SO4]B:406 |
-x,y-1/2,-z+3/2 |
4_546 |
1 |
1 |
185 |
2.4 |
-0.3 |
0.613 |
0 |
0 |
0 |
0.000 |
42 |
44 |
|
B |
1 |
1 |
16080 |
◊ |
[SO4]B:405 |
-x,y-1/2,-z+3/2 |
4_546 |
1 |
1 |
186 |
1.4 |
-0.1 |
0.837 |
0 |
0 |
0 |
0.000 |
|