## |
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 |
|
F |
74 |
20 |
7563 |
◊ |
A |
x,y,z |
1_555 |
72 |
19 |
7591 |
652.3 |
-10.2 |
0.104 |
6 |
0 |
0 |
0.145 |
2 |
2 |
|
A |
68 |
21 |
7591 |
◊ |
F |
-x,y-1/2,-z |
2_545 |
62 |
19 |
7563 |
616.5 |
-2.8 |
0.512 |
3 |
3 |
0 |
0.000 |
3 |
|
A |
58 |
18 |
7591 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
67 |
19 |
7563 |
551.5 |
-6.2 |
0.244 |
1 |
2 |
0 |
0.000 |
Average: |
584.0 |
-4.5 |
0.378 |
2 |
3 |
0 |
0.000 |
3 |
4 |
|
A |
30 |
9 |
7591 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
34 |
12 |
7563 |
273.0 |
-0.1 |
0.654 |
1 |
2 |
0 |
0.000 |
4 |
5 |
|
A |
33 |
10 |
7591 |
x |
A |
x-1,y,z |
1_455 |
29 |
9 |
7591 |
265.8 |
-0.2 |
0.651 |
0 |
0 |
0 |
0.000 |
5 |
6 |
|
F |
22 |
7 |
7563 |
x |
F |
x-1,y,z |
1_455 |
25 |
9 |
7563 |
212.7 |
0.8 |
0.727 |
2 |
0 |
0 |
0.000 |
6 |
7 |
|
[5FW]A:1000 |
14 |
1 |
407 |
f |
A |
x,y,z |
1_555 |
31 |
7 |
7591 |
208.0 |
-2.4 |
0.607 |
5 |
0 |
0 |
0.089 |
8 |
|
[5FW]F:1001 |
14 |
1 |
403 |
f |
F |
x,y,z |
1_555 |
32 |
8 |
7563 |
207.8 |
-1.1 |
0.776 |
5 |
0 |
0 |
0.089 |
Average: |
207.9 |
-1.8 |
0.692 |
5 |
0 |
0 |
0.089 |
7 |
9 |
|
F |
19 |
7 |
7563 |
x |
F |
-x,y-1/2,-z |
2_545 |
25 |
12 |
7563 |
185.6 |
-0.5 |
0.552 |
3 |
0 |
0 |
0.000 |
10 |
|
A |
26 |
12 |
7591 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
16 |
7 |
7591 |
180.0 |
-1.0 |
0.505 |
2 |
0 |
0 |
0.000 |
Average: |
182.8 |
-0.7 |
0.528 |
3 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
22 |
9 |
7591 |
f |
[5FW]A:1002 |
-x,y-1/2,-z+1 |
2_546 |
15 |
1 |
405 |
175.6 |
-2.1 |
0.673 |
2 |
0 |
0 |
0.033 |
9 |
12 |
|
[5FW]A:1001 |
9 |
1 |
406 |
f |
A |
x-1,y,z |
1_455 |
25 |
9 |
7591 |
146.8 |
-1.6 |
0.558 |
3 |
0 |
0 |
0.033 |
10 |
13 |
|
F |
23 |
7 |
7563 |
f |
[5FW]F:1000 |
-x,y-1/2,-z |
2_545 |
13 |
1 |
402 |
138.2 |
-2.0 |
0.573 |
1 |
0 |
0 |
0.027 |
11 |
14 |
|
[5FW]F:1000 |
12 |
1 |
402 |
◊ |
F |
x,y,z |
1_555 |
19 |
7 |
7563 |
120.4 |
-1.6 |
0.652 |
1 |
0 |
0 |
0.000 |
12 |
15 |
|
[5FW]A:1001 |
13 |
1 |
406 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
19 |
7 |
7563 |
112.3 |
-0.7 |
0.733 |
3 |
0 |
0 |
0.000 |
13 |
16 |
|
[SO4]F:1154 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
18 |
6 |
7563 |
96.9 |
-14.4 |
0.753 |
3 |
0 |
0 |
0.176 |
14 |
17 |
|
[5FW]A:1001 |
11 |
1 |
406 |
◊ |
A |
x,y,z |
1_555 |
14 |
3 |
7591 |
96.2 |
-1.2 |
0.614 |
1 |
0 |
0 |
0.000 |
15 |
18 |
|
[SO4]A:1154 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
7591 |
95.1 |
-13.9 |
0.743 |
3 |
0 |
0 |
0.171 |
16 |
19 |
|
[5FW]A:1002 |
12 |
1 |
405 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
7591 |
91.7 |
-0.9 |
0.735 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[SO4]F:1159 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
15 |
5 |
7563 |
85.9 |
-12.9 |
0.679 |
1 |
0 |
0 |
0.150 |
18 |
21 |
|
[SO4]A:1155 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
7591 |
85.2 |
-12.7 |
0.656 |
1 |
0 |
0 |
0.148 |
19 |
22 |
|
A |
17 |
7 |
7591 |
f |
[ACT]A:1156 |
x-1,y,z |
1_455 |
4 |
1 |
184 |
79.0 |
-0.2 |
0.652 |
2 |
0 |
0 |
0.013 |
20 |
23 |
|
[ACT]F:1158 |
4 |
1 |
184 |
f |
F |
x,y,z |
1_555 |
11 |
5 |
7563 |
75.8 |
-0.4 |
0.662 |
2 |
0 |
0 |
0.014 |
21 |
24 |
|
[ACT]A:1156 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
7591 |
62.1 |
0.5 |
0.827 |
2 |
0 |
0 |
0.000 |
22 |
25 |
|
[5FW]A:1002 |
4 |
1 |
405 |
◊ |
F |
x,y,z |
1_555 |
6 |
3 |
7563 |
48.4 |
-0.3 |
0.683 |
0 |
0 |
0 |
0.000 |
23 |
26 |
|
A |
4 |
1 |
7591 |
◊ |
[5FW]F:1000 |
x,y-1,z |
1_545 |
5 |
1 |
402 |
44.4 |
-0.2 |
0.732 |
1 |
0 |
0 |
0.000 |
24 |
27 |
|
[SO4]A:1155 |
3 |
1 |
186 |
◊ |
F |
-x,y-1/2,-z |
2_545 |
2 |
1 |
7563 |
25.5 |
-2.5 |
0.946 |
1 |
0 |
0 |
0.000 |
25 |
28 |
|
[5FW]A:1002 |
3 |
1 |
405 |
◊ |
[5FW]A:1000 |
x,y,z |
1_555 |
2 |
1 |
407 |
22.8 |
-0.5 |
0.667 |
0 |
0 |
0 |
0.000 |
26 |
29 |
|
A |
1 |
1 |
7591 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
7591 |
22.0 |
0.7 |
0.569 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
A |
4 |
3 |
7591 |
◊ |
F |
x,y-1,z |
1_545 |
2 |
1 |
7563 |
9.1 |
0.2 |
0.706 |
0 |
0 |
0 |
0.000 |
28 |
31 |
|
[5FW]A:1001 |
1 |
1 |
406 |
◊ |
[ACT]A:1156 |
x-1,y,z |
1_455 |
1 |
1 |
184 |
7.0 |
-0.2 |
0.577 |
0 |
0 |
0 |
0.000 |
29 |
32 |
|
[5FW]F:1001 |
1 |
1 |
403 |
◊ |
F |
-x,y-1/2,-z |
2_545 |
1 |
1 |
7563 |
2.8 |
0.1 |
0.776 |
0 |
0 |
0 |
0.000 |
30 |
33 |
|
A |
1 |
1 |
7591 |
◊ |
[SO4]F:1154 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
185 |
2.2 |
-0.3 |
0.664 |
0 |
0 |
0 |
0.000 |
31 |
34 |
|
[ACT]A:1156 |
1 |
1 |
184 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
7563 |
1.8 |
0.0 |
0.583 |
0 |
0 |
0 |
0.000 |
32 |
35 |
|
A |
1 |
1 |
7591 |
◊ |
[SO4]F:1159 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
185 |
1.3 |
-0.2 |
0.709 |
0 |
0 |
0 |
0.000 |
33 |
36 |
|
[SO4]A:1154 |
1 |
1 |
184 |
◊ |
F |
-x,y-1/2,-z |
2_545 |
1 |
1 |
7563 |
0.7 |
-0.1 |
0.732 |
0 |
0 |
0 |
0.000 |
34 |
37 |
|
F |
1 |
1 |
7563 |
x |
F |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
7563 |
0.2 |
0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
|