| ## |
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 |
365 |
85 |
10317 |
◊ |
D |
x,y,z |
1_555 |
422 |
112 |
30506 |
3724.1 |
-40.7 |
0.092 |
30 |
16 |
0 |
1.000 |
2 |
|
C |
368 |
85 |
10437 |
◊ |
A |
x,y,z |
1_555 |
419 |
112 |
30671 |
3713.9 |
-43.1 |
0.060 |
32 |
16 |
0 |
1.000 |
| Average: |
3719.0 |
-41.9 |
0.076 |
31 |
16 |
0 |
1.000 |
| 2 |
3 |
|
B |
293 |
74 |
28238 |
◊ |
A |
x,y,z |
1_555 |
317 |
96 |
30671 |
2985.4 |
-32.7 |
0.012 |
26 |
19 |
0 |
0.623 |
4 |
|
E |
287 |
73 |
28050 |
◊ |
D |
x,y,z |
1_555 |
316 |
95 |
30506 |
2965.6 |
-30.4 |
0.015 |
26 |
17 |
0 |
0.623 |
| Average: |
2975.5 |
-31.6 |
0.014 |
26 |
18 |
0 |
0.623 |
| 3 |
5 |
|
D |
296 |
74 |
30506 |
◊ |
A |
x,y,z |
1_555 |
297 |
74 |
30671 |
2868.3 |
-20.6 |
0.236 |
24 |
6 |
0 |
1.000 |
| 4 |
6 |
|
B |
66 |
20 |
28238 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
62 |
13 |
10437 |
542.5 |
-0.9 |
0.611 |
1 |
4 |
0 |
0.000 |
| 5 |
7 |
|
[AMP]E:801 |
22 |
1 |
494 |
f |
E |
x,y,z |
1_555 |
60 |
28 |
28050 |
354.6 |
-4.2 |
0.417 |
4 |
0 |
0 |
0.082 |
8 |
|
[AMP]B:801 |
22 |
1 |
497 |
f |
B |
x,y,z |
1_555 |
60 |
28 |
28238 |
354.1 |
-4.0 |
0.427 |
5 |
0 |
0 |
0.082 |
| Average: |
354.3 |
-4.1 |
0.422 |
5 |
0 |
0 |
0.082 |
| 6 |
9 |
|
E |
29 |
9 |
28050 |
◊ |
F |
-x+1,y-1/2,-z+3/2 |
3_646 |
36 |
12 |
10317 |
286.5 |
-0.2 |
0.634 |
2 |
1 |
0 |
0.000 |
| 7 |
10 |
|
F |
25 |
8 |
10317 |
◊ |
E |
x,y,z |
1_555 |
32 |
9 |
28050 |
282.9 |
-2.7 |
0.323 |
0 |
1 |
0 |
0.026 |
11 |
|
C |
27 |
8 |
10437 |
◊ |
B |
x,y,z |
1_555 |
35 |
10 |
28238 |
281.7 |
-3.5 |
0.219 |
0 |
1 |
0 |
0.026 |
| Average: |
282.3 |
-3.1 |
0.271 |
0 |
1 |
0 |
0.026 |
| 8 |
12 |
|
B |
16 |
6 |
28238 |
◊ |
A |
x,y-1,z |
1_545 |
19 |
5 |
30671 |
143.4 |
-0.7 |
0.350 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
[SO4]B:802 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
24 |
15 |
28238 |
126.3 |
-17.1 |
0.643 |
0 |
0 |
0 |
0.226 |
| 10 |
14 |
|
[SO4]E:802 |
5 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
24 |
15 |
28050 |
121.5 |
-17.1 |
0.632 |
0 |
0 |
0 |
0.234 |
| 11 |
15 |
|
F |
12 |
4 |
10317 |
◊ |
E |
x-1,y,z |
1_455 |
11 |
5 |
28050 |
104.7 |
1.1 |
0.814 |
0 |
1 |
0 |
0.000 |
| 12 |
16 |
|
E |
7 |
2 |
28050 |
x |
E |
-x+1,y-1/2,-z+3/2 |
3_646 |
12 |
3 |
28050 |
63.4 |
1.3 |
0.768 |
2 |
0 |
0 |
0.000 |
| 13 |
17 |
|
A |
7 |
2 |
30671 |
x |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
6 |
2 |
30671 |
55.5 |
1.3 |
0.880 |
0 |
1 |
0 |
0.000 |
| 14 |
18 |
|
D |
9 |
5 |
30506 |
◊ |
E |
x-1,y,z |
1_455 |
10 |
5 |
28050 |
49.8 |
0.9 |
0.683 |
0 |
0 |
0 |
0.000 |
| 15 |
19 |
|
B |
6 |
3 |
28238 |
◊ |
D |
x,y-1,z |
1_545 |
9 |
6 |
30506 |
48.9 |
0.9 |
0.810 |
0 |
1 |
0 |
0.000 |
| 16 |
20 |
|
[SO4]E:802 |
3 |
1 |
184 |
f |
[AMP]E:801 |
x,y,z |
1_555 |
4 |
1 |
494 |
36.1 |
-5.6 |
0.529 |
0 |
0 |
0 |
0.076 |
| 17 |
21 |
|
[SO4]B:802 |
3 |
1 |
185 |
f |
[AMP]B:801 |
x,y,z |
1_555 |
3 |
1 |
497 |
31.5 |
-5.3 |
0.586 |
0 |
0 |
0 |
0.070 |
| 18 |
22 |
|
B |
2 |
1 |
28238 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
2 |
30671 |
29.0 |
0.5 |
0.787 |
0 |
1 |
0 |
0.000 |
| 19 |
23 |
|
E |
1 |
1 |
28050 |
◊ |
D |
-x+1,y-1/2,-z+3/2 |
3_646 |
1 |
1 |
30506 |
1.1 |
-0.0 |
0.573 |
0 |
0 |
0 |
0.000 |
|