| ## |
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 |
|
C |
80 |
22 |
10111 |
◊ |
A |
x,y,z |
1_555 |
77 |
22 |
10207 |
747.4 |
-2.5 |
0.409 |
5 |
0 |
0 |
0.000 |
2 |
|
D |
75 |
23 |
10179 |
◊ |
B |
x,y,z |
1_555 |
76 |
21 |
10171 |
718.3 |
-5.6 |
0.231 |
3 |
0 |
0 |
0.000 |
| Average: |
732.8 |
-4.1 |
0.320 |
4 |
0 |
0 |
0.000 |
| 2 |
3 |
|
B |
67 |
20 |
10171 |
◊ |
A |
x,y,z-1 |
1_554 |
62 |
20 |
10207 |
567.7 |
-3.4 |
0.336 |
5 |
0 |
0 |
0.055 |
| 3 |
4 |
|
D |
57 |
16 |
10179 |
◊ |
C |
x,y,z |
1_555 |
51 |
14 |
10111 |
456.8 |
-6.9 |
0.104 |
4 |
0 |
0 |
0.000 |
| 4 |
5 |
|
D |
37 |
13 |
10179 |
x |
D |
x,y-1,z |
1_545 |
39 |
14 |
10179 |
372.2 |
-1.4 |
0.430 |
4 |
0 |
0 |
0.000 |
6 |
|
A |
38 |
11 |
10207 |
x |
A |
x-1,y,z |
1_455 |
38 |
13 |
10207 |
362.5 |
-0.6 |
0.423 |
4 |
2 |
0 |
0.000 |
7 |
|
C |
38 |
13 |
10111 |
x |
C |
x-1,y,z |
1_455 |
36 |
12 |
10111 |
350.5 |
-1.5 |
0.393 |
4 |
0 |
0 |
0.000 |
8 |
|
B |
33 |
13 |
10171 |
x |
B |
x,y-1,z |
1_545 |
38 |
10 |
10171 |
344.6 |
0.0 |
0.474 |
4 |
1 |
0 |
0.000 |
| Average: |
357.4 |
-0.8 |
0.430 |
4 |
1 |
0 |
0.000 |
| 5 |
9 |
|
B |
43 |
11 |
10171 |
◊ |
A |
x-1,y,z-1 |
1_454 |
39 |
15 |
10207 |
367.7 |
-3.6 |
0.259 |
1 |
1 |
0 |
0.000 |
10 |
|
B |
32 |
12 |
10171 |
◊ |
A |
x,y-1,z-1 |
1_544 |
38 |
11 |
10207 |
322.7 |
-3.6 |
0.224 |
1 |
1 |
0 |
0.000 |
| Average: |
345.2 |
-3.6 |
0.241 |
1 |
1 |
0 |
0.000 |
| 6 |
11 |
|
[GOL]B:1002 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
10171 |
118.1 |
0.1 |
0.573 |
2 |
0 |
0 |
0.015 |
12 |
|
[GOL]A:1001 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
10207 |
117.4 |
0.1 |
0.566 |
2 |
0 |
0 |
0.015 |
| Average: |
117.8 |
0.1 |
0.570 |
2 |
0 |
0 |
0.015 |
| 7 |
13 |
|
[SO4]D:1008 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
10179 |
101.5 |
-14.3 |
0.843 |
5 |
0 |
0 |
0.100 |
| 8 |
14 |
|
C |
11 |
4 |
10111 |
◊ |
D |
x-1,y-1,z |
1_445 |
9 |
4 |
10179 |
100.3 |
2.4 |
0.864 |
1 |
0 |
0 |
0.000 |
| 9 |
15 |
|
[SO4]C:1007 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
10111 |
99.2 |
-13.2 |
0.884 |
4 |
0 |
0 |
0.100 |
| 10 |
16 |
|
[SO4]A:1005 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
10207 |
80.3 |
-12.5 |
0.807 |
5 |
0 |
0 |
0.285 |
17 |
|
[SO4]B:1006 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
10171 |
79.7 |
-12.5 |
0.807 |
5 |
0 |
0 |
0.285 |
| Average: |
80.0 |
-12.5 |
0.807 |
5 |
0 |
0 |
0.285 |
| 11 |
18 |
|
[SO4]A:1003 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
10207 |
76.4 |
-8.8 |
0.823 |
1 |
0 |
0 |
0.180 |
19 |
|
[SO4]B:1004 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
10171 |
75.9 |
-8.9 |
0.826 |
1 |
0 |
0 |
0.180 |
| Average: |
76.2 |
-8.9 |
0.825 |
1 |
0 |
0 |
0.180 |
| 12 |
20 |
|
[SO4]B:1010 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
10171 |
74.6 |
-9.6 |
0.850 |
1 |
0 |
0 |
0.097 |
| 13 |
21 |
|
B |
7 |
3 |
10171 |
◊ |
[SO4]A:1003 |
x,y,z-1 |
1_554 |
5 |
1 |
187 |
58.5 |
-6.9 |
0.806 |
2 |
0 |
0 |
0.150 |
22 |
|
[SO4]B:1004 |
5 |
1 |
186 |
◊ |
A |
x,y,z-1 |
1_554 |
7 |
3 |
10207 |
58.1 |
-6.8 |
0.804 |
2 |
0 |
0 |
0.150 |
| Average: |
58.3 |
-6.9 |
0.805 |
2 |
0 |
0 |
0.150 |
| 14 |
23 |
|
A |
6 |
3 |
10207 |
f |
[SO4]A:1009 |
x-1,y,z |
1_455 |
4 |
1 |
184 |
53.5 |
-5.2 |
0.923 |
3 |
0 |
0 |
0.063 |
| 15 |
24 |
|
[SO4]A:1009 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
10207 |
40.9 |
-4.8 |
0.702 |
0 |
0 |
0 |
0.000 |
| 16 |
25 |
|
[GOL]B:1002 |
4 |
1 |
220 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
1 |
10207 |
34.5 |
0.6 |
0.769 |
2 |
0 |
0 |
0.005 |
26 |
|
B |
2 |
1 |
10171 |
◊ |
[GOL]A:1001 |
x,y,z-1 |
1_554 |
4 |
1 |
218 |
34.4 |
0.6 |
0.770 |
2 |
0 |
0 |
0.005 |
| Average: |
34.4 |
0.6 |
0.770 |
2 |
0 |
0 |
0.005 |
| 17 |
27 |
|
[GOL]B:1002 |
2 |
1 |
220 |
f |
[SO4]B:1004 |
x,y,z |
1_555 |
4 |
1 |
186 |
32.0 |
-3.5 |
0.763 |
1 |
0 |
0 |
0.075 |
28 |
|
[GOL]A:1001 |
2 |
1 |
218 |
f |
[SO4]A:1003 |
x,y,z |
1_555 |
4 |
1 |
187 |
31.6 |
-3.4 |
0.763 |
1 |
0 |
0 |
0.075 |
| Average: |
31.8 |
-3.4 |
0.763 |
1 |
0 |
0 |
0.075 |
| 18 |
29 |
|
[SO4]B:1010 |
3 |
1 |
185 |
◊ |
A |
x-1,y-1,z-1 |
1_444 |
5 |
1 |
10207 |
20.9 |
-2.4 |
0.834 |
0 |
0 |
0 |
0.000 |
| 19 |
30 |
|
[GOL]B:1002 |
2 |
1 |
220 |
f |
[SO4]B:1006 |
x,y,z |
1_555 |
3 |
1 |
184 |
15.6 |
-1.7 |
0.796 |
0 |
0 |
0 |
0.033 |
31 |
|
[GOL]A:1001 |
2 |
1 |
218 |
f |
[SO4]A:1005 |
x,y,z |
1_555 |
3 |
1 |
184 |
15.2 |
-1.7 |
0.796 |
0 |
0 |
0 |
0.033 |
| Average: |
15.4 |
-1.7 |
0.796 |
0 |
0 |
0 |
0.033 |
| 20 |
32 |
|
[SO4]B:1004 |
1 |
1 |
186 |
◊ |
[SO4]A:1003 |
x,y,z-1 |
1_554 |
1 |
1 |
187 |
11.6 |
-2.8 |
0.800 |
0 |
0 |
0 |
0.027 |
| 21 |
33 |
|
[SO4]B:1006 |
4 |
1 |
184 |
◊ |
A |
x,y,z-1 |
1_554 |
4 |
2 |
10207 |
10.7 |
-0.8 |
0.843 |
0 |
0 |
0 |
0.014 |
34 |
|
B |
4 |
2 |
10171 |
◊ |
[SO4]A:1005 |
x,y,z-1 |
1_554 |
4 |
1 |
184 |
9.9 |
-0.7 |
0.843 |
0 |
0 |
0 |
0.014 |
| Average: |
10.3 |
-0.7 |
0.843 |
0 |
0 |
0 |
0.014 |
| 22 |
35 |
|
C |
4 |
2 |
10111 |
x |
C |
x,y-1,z |
1_545 |
1 |
1 |
10111 |
9.1 |
0.3 |
0.709 |
0 |
0 |
0 |
0.000 |
| 23 |
36 |
|
A |
1 |
1 |
10207 |
x |
A |
x,y-1,z |
1_545 |
1 |
1 |
10207 |
4.9 |
0.2 |
0.814 |
0 |
0 |
0 |
0.000 |
| 24 |
37 |
|
B |
1 |
1 |
10171 |
◊ |
A |
x-1,y-1,z-1 |
1_444 |
1 |
1 |
10207 |
2.8 |
-0.1 |
0.411 |
0 |
0 |
0 |
0.000 |
| 25 |
38 |
|
C |
1 |
1 |
10111 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
10179 |
1.0 |
0.0 |
0.691 |
0 |
0 |
0 |
0.000 |
| 26 |
39 |
|
A |
1 |
1 |
10207 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
10111 |
0.1 |
0.0 |
0.665 |
0 |
0 |
0 |
0.000 |
|