| ## |
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 |
111 |
34 |
12982 |
◊ |
A |
-x+2,y,-z+3/2 |
3_756 |
111 |
34 |
12982 |
1128.0 |
-5.7 |
0.282 |
3 |
0 |
0 |
0.000 |
2 |
|
C |
108 |
33 |
12900 |
◊ |
B |
x,y,z |
1_555 |
112 |
34 |
12855 |
1091.5 |
-6.9 |
0.209 |
5 |
0 |
0 |
0.000 |
| Average: |
1109.8 |
-6.3 |
0.246 |
4 |
0 |
0 |
0.000 |
| 2 |
3 |
|
B |
63 |
19 |
12855 |
◊ |
A |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
63 |
19 |
12982 |
587.9 |
-2.3 |
0.400 |
1 |
2 |
0 |
0.000 |
| 3 |
4 |
|
B |
39 |
14 |
12855 |
◊ |
C |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
37 |
14 |
12900 |
290.3 |
-3.5 |
0.211 |
0 |
0 |
0 |
0.000 |
| 4 |
5 |
|
C |
27 |
9 |
12900 |
◊ |
A |
-x+3/2,y-1/2,-z+3/2 |
7_646 |
29 |
9 |
12982 |
261.4 |
1.1 |
0.654 |
2 |
0 |
0 |
0.000 |
| 5 |
6 |
|
[SFU]A:402 |
12 |
1 |
336 |
f |
A |
x,y,z |
1_555 |
26 |
12 |
12982 |
191.1 |
3.9 |
0.752 |
2 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[SFU]B:402 |
12 |
1 |
341 |
◊ |
B |
x,y,z |
1_555 |
28 |
12 |
12855 |
190.2 |
2.2 |
0.586 |
2 |
0 |
0 |
0.000 |
8 |
|
[SFU]C:402 |
12 |
1 |
343 |
◊ |
C |
x,y,z |
1_555 |
28 |
12 |
12900 |
185.2 |
2.5 |
0.584 |
3 |
0 |
0 |
0.000 |
| Average: |
187.7 |
2.4 |
0.585 |
3 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[SFU]B:404 |
12 |
1 |
335 |
f |
B |
x,y,z |
1_555 |
26 |
12 |
12855 |
187.8 |
2.8 |
0.665 |
3 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[SFU]C:404 |
12 |
1 |
340 |
f |
C |
x,y,z |
1_555 |
28 |
13 |
12900 |
181.7 |
2.8 |
0.660 |
3 |
0 |
0 |
0.000 |
11 |
|
[SFU]A:404 |
12 |
1 |
337 |
f |
A |
x,y,z |
1_555 |
27 |
12 |
12982 |
181.6 |
2.6 |
0.632 |
3 |
0 |
0 |
0.000 |
| Average: |
181.7 |
2.7 |
0.646 |
3 |
0 |
0 |
0.000 |
| 9 |
12 |
|
A |
17 |
8 |
12982 |
◊ |
C |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
17 |
7 |
12900 |
173.0 |
-1.0 |
0.388 |
0 |
2 |
0 |
0.000 |
| 10 |
13 |
|
[SFU]C:403 |
12 |
1 |
329 |
f |
C |
x,y,z |
1_555 |
25 |
12 |
12900 |
172.6 |
2.8 |
0.662 |
2 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[SFU]A:403 |
12 |
1 |
336 |
◊ |
A |
x,y,z |
1_555 |
22 |
11 |
12982 |
168.5 |
3.2 |
0.677 |
2 |
0 |
0 |
0.000 |
15 |
|
[SFU]B:403 |
12 |
1 |
335 |
◊ |
B |
x,y,z |
1_555 |
24 |
11 |
12855 |
168.0 |
2.8 |
0.657 |
2 |
0 |
0 |
0.000 |
| Average: |
168.3 |
3.0 |
0.667 |
2 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[SFU]A:401 |
12 |
1 |
336 |
◊ |
A |
x,y,z |
1_555 |
18 |
8 |
12982 |
167.7 |
3.7 |
0.731 |
2 |
0 |
0 |
0.000 |
17 |
|
[SFU]B:401 |
12 |
1 |
332 |
◊ |
B |
x,y,z |
1_555 |
20 |
8 |
12855 |
164.2 |
3.5 |
0.730 |
2 |
0 |
0 |
0.000 |
| Average: |
165.9 |
3.6 |
0.730 |
2 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[SFU]A:405 |
12 |
1 |
337 |
f |
A |
x,y,z |
1_555 |
22 |
10 |
12982 |
163.5 |
3.3 |
0.711 |
2 |
0 |
0 |
0.000 |
| 14 |
19 |
|
[SFU]B:405 |
12 |
1 |
339 |
f |
B |
x,y,z |
1_555 |
21 |
10 |
12855 |
163.0 |
3.3 |
0.721 |
2 |
0 |
0 |
0.000 |
| 15 |
20 |
|
[SFU]C:401 |
12 |
1 |
335 |
f |
C |
x,y,z |
1_555 |
19 |
8 |
12900 |
163.0 |
3.4 |
0.740 |
2 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[SFU]C:405 |
11 |
1 |
333 |
f |
C |
x,y,z |
1_555 |
21 |
10 |
12900 |
162.8 |
3.1 |
0.718 |
2 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[SO4]C:406 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
12900 |
77.5 |
-10.7 |
0.852 |
2 |
0 |
0 |
0.223 |
| 18 |
23 |
|
[SO4]A:406 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
12982 |
76.0 |
-10.2 |
0.846 |
1 |
0 |
0 |
0.042 |
| 19 |
24 |
|
[SO4]A:408 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
12982 |
75.2 |
-9.7 |
0.780 |
0 |
0 |
0 |
0.039 |
| 20 |
25 |
|
[SO4]A:407 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
12982 |
60.3 |
-7.1 |
0.888 |
1 |
0 |
0 |
0.030 |
| 21 |
26 |
|
C |
6 |
3 |
12900 |
f |
[SFU]A:401 |
-x+3/2,y-1/2,-z+3/2 |
7_646 |
4 |
1 |
336 |
44.6 |
-0.8 |
0.409 |
0 |
0 |
0 |
0.015 |
| 22 |
27 |
|
[SFU]B:402 |
3 |
1 |
341 |
◊ |
C |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
4 |
3 |
12900 |
36.6 |
-1.4 |
0.268 |
0 |
0 |
0 |
0.000 |
| 23 |
28 |
|
B |
2 |
1 |
12855 |
◊ |
[SO4]A:407 |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
4 |
1 |
185 |
33.7 |
-3.4 |
0.960 |
1 |
0 |
0 |
0.000 |
| 24 |
29 |
|
[SFU]A:405 |
4 |
1 |
337 |
◊ |
C |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
4 |
2 |
12900 |
32.7 |
-0.0 |
0.554 |
0 |
0 |
0 |
0.000 |
| 25 |
30 |
|
[SFU]B:402 |
2 |
1 |
341 |
f |
[SFU]C:402 |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
2 |
1 |
343 |
26.7 |
-1.4 |
0.266 |
0 |
0 |
0 |
0.100 |
| 26 |
31 |
|
[SO4]A:408 |
4 |
1 |
186 |
f |
[SFU]A:404 |
x,y,z |
1_555 |
4 |
1 |
337 |
24.1 |
-2.7 |
0.665 |
0 |
0 |
0 |
0.011 |
| 27 |
32 |
|
B |
3 |
2 |
12855 |
◊ |
[SFU]C:402 |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
1 |
1 |
343 |
15.0 |
-0.2 |
0.458 |
0 |
0 |
0 |
0.000 |
| 28 |
33 |
|
C |
2 |
2 |
12900 |
◊ |
C |
x,-y,-z+2 |
4_557 |
2 |
2 |
12900 |
12.1 |
0.8 |
0.892 |
0 |
0 |
0 |
0.000 |
| 29 |
34 |
|
[SO4]A:406 |
1 |
1 |
185 |
f |
[SFU]A:405 |
x,y,z |
1_555 |
4 |
1 |
337 |
10.6 |
-1.1 |
0.631 |
0 |
0 |
0 |
0.004 |
| 30 |
35 |
|
[SO4]C:406 |
2 |
1 |
186 |
f |
[SFU]C:405 |
x,y,z |
1_555 |
3 |
1 |
333 |
8.8 |
-0.9 |
0.726 |
0 |
0 |
0 |
0.018 |
| 31 |
36 |
|
[SO4]A:406 |
1 |
1 |
185 |
◊ |
C |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
2 |
1 |
12900 |
7.7 |
-0.8 |
0.769 |
0 |
0 |
0 |
0.000 |
| 32 |
37 |
|
[SFU]B:403 |
1 |
1 |
335 |
f |
C |
-x+3/2,-y+1/2,z-1/2 |
6_654 |
1 |
1 |
12900 |
1.0 |
-0.0 |
0.407 |
0 |
0 |
0 |
0.000 |
|