| ## |
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 |
|
B |
91 |
26 |
6753 |
◊ |
A |
x,y,z |
1_555 |
93 |
28 |
6170 |
847.6 |
-8.8 |
0.216 |
10 |
4 |
0 |
0.141 |
2 |
|
D |
84 |
25 |
6070 |
◊ |
C |
x,y,z |
1_555 |
84 |
25 |
6769 |
779.1 |
-7.4 |
0.285 |
10 |
4 |
0 |
0.141 |
| Average: |
813.4 |
-8.1 |
0.251 |
10 |
4 |
0 |
0.141 |
| 2 |
3 |
|
C |
69 |
16 |
6769 |
◊ |
B |
x,y,z |
1_555 |
70 |
17 |
6753 |
681.1 |
-5.5 |
0.350 |
14 |
7 |
0 |
0.150 |
| 3 |
4 |
|
C |
52 |
15 |
6769 |
◊ |
A |
x,y,z |
1_555 |
49 |
12 |
6170 |
511.2 |
-7.4 |
0.137 |
3 |
0 |
0 |
0.070 |
5 |
|
D |
46 |
13 |
6070 |
◊ |
B |
x,y,z |
1_555 |
55 |
16 |
6753 |
444.1 |
-5.8 |
0.234 |
2 |
0 |
0 |
0.070 |
| Average: |
477.7 |
-6.6 |
0.185 |
3 |
0 |
0 |
0.070 |
| 4 |
6 |
|
G |
35 |
6 |
1002 |
◊ |
D |
x,y,z |
1_555 |
56 |
17 |
6070 |
449.9 |
-7.7 |
0.391 |
12 |
3 |
0 |
0.347 |
7 |
|
H |
34 |
6 |
947 |
◊ |
C |
x,y,z |
1_555 |
51 |
18 |
6769 |
443.5 |
-6.2 |
0.390 |
16 |
3 |
0 |
0.347 |
8 |
|
F |
35 |
6 |
946 |
◊ |
B |
x,y,z |
1_555 |
58 |
18 |
6753 |
442.5 |
-8.2 |
0.342 |
16 |
3 |
0 |
0.347 |
9 |
|
E |
34 |
6 |
963 |
◊ |
A |
x,y,z |
1_555 |
52 |
17 |
6170 |
439.0 |
-8.6 |
0.311 |
12 |
3 |
0 |
0.347 |
| Average: |
443.7 |
-7.7 |
0.358 |
14 |
3 |
0 |
0.347 |
| 5 |
10 |
|
B |
27 |
8 |
6753 |
◊ |
A |
-y+3/2,x+3/2,z+1/4 |
3_665 |
37 |
11 |
6170 |
281.4 |
-1.3 |
0.546 |
1 |
2 |
0 |
0.000 |
11 |
|
D |
28 |
8 |
6070 |
◊ |
C |
-y+3/2,x+1/2,z+1/4 |
3_655 |
38 |
10 |
6769 |
272.8 |
-1.5 |
0.530 |
2 |
2 |
0 |
0.000 |
| Average: |
277.1 |
-1.4 |
0.538 |
2 |
2 |
0 |
0.000 |
| 6 |
12 |
|
C |
27 |
7 |
6769 |
◊ |
A |
-x+1/2,y-1/2,-z+5/4 |
5_546 |
30 |
7 |
6170 |
250.2 |
-3.5 |
0.283 |
2 |
0 |
0 |
0.000 |
| 7 |
13 |
|
[SO4]A:500 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
6170 |
110.0 |
-17.3 |
0.781 |
8 |
0 |
0 |
0.349 |
| 8 |
14 |
|
[SO4]C:502 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
6769 |
105.2 |
-17.4 |
0.693 |
5 |
0 |
0 |
0.351 |
| 9 |
15 |
|
[SO4]B:501 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
6753 |
102.1 |
-15.3 |
0.739 |
5 |
0 |
0 |
0.384 |
| 10 |
16 |
|
[SO4]D:503 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
14 |
7 |
6070 |
98.4 |
-15.0 |
0.756 |
5 |
0 |
0 |
0.469 |
| 11 |
17 |
|
[SO4]A:508 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
6170 |
78.3 |
-11.6 |
0.663 |
2 |
0 |
0 |
0.210 |
| 12 |
18 |
|
[SO4]B:509 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
6753 |
77.4 |
-10.4 |
0.691 |
2 |
0 |
0 |
0.249 |
| 13 |
19 |
|
[SO4]D:506 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
6070 |
77.4 |
-11.3 |
0.762 |
3 |
0 |
0 |
0.343 |
| 14 |
20 |
|
[SO4]C:507 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
6769 |
75.7 |
-10.5 |
0.619 |
2 |
0 |
0 |
0.204 |
| 15 |
21 |
|
[SO4]B:504 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
6170 |
68.7 |
-9.9 |
0.702 |
3 |
0 |
0 |
0.188 |
| 16 |
22 |
|
[ACE]G:555 |
3 |
1 |
173 |
cf |
G |
x,y,z |
1_555 |
7 |
3 |
1002 |
68.3 |
-0.4 |
0.794 |
0 |
0 |
0 |
0.100 |
| 17 |
23 |
|
[SO4]B:504 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
6753 |
67.3 |
-10.0 |
0.596 |
2 |
0 |
0 |
0.111 |
| 18 |
24 |
|
[SO4]D:505 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
6769 |
63.8 |
-8.8 |
0.631 |
3 |
0 |
0 |
0.182 |
| 19 |
25 |
|
[SO4]D:505 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
7 |
4 |
6070 |
62.2 |
-8.7 |
0.621 |
2 |
0 |
0 |
0.103 |
| 20 |
26 |
|
[ACE]F:555 |
3 |
1 |
171 |
cf |
F |
x,y,z |
1_555 |
6 |
2 |
946 |
56.7 |
-0.6 |
0.777 |
0 |
0 |
0 |
0.100 |
| 21 |
27 |
|
[ACE]E:555 |
3 |
1 |
173 |
cf |
E |
x,y,z |
1_555 |
4 |
1 |
963 |
56.7 |
-0.7 |
0.739 |
0 |
0 |
0 |
0.100 |
| 22 |
28 |
|
[ACE]H:555 |
3 |
1 |
172 |
cf |
H |
x,y,z |
1_555 |
4 |
1 |
947 |
56.1 |
-0.7 |
0.753 |
0 |
0 |
0 |
0.100 |
| 23 |
29 |
|
C |
4 |
1 |
6769 |
◊ |
E |
-x+1/2,y-1/2,-z+5/4 |
5_546 |
9 |
3 |
963 |
53.9 |
0.6 |
0.812 |
0 |
0 |
0 |
0.000 |
30 |
|
H |
8 |
2 |
947 |
◊ |
A |
-x+1/2,y-1/2,-z+5/4 |
5_546 |
4 |
1 |
6170 |
40.7 |
0.5 |
0.802 |
1 |
0 |
0 |
0.000 |
| Average: |
47.3 |
0.6 |
0.807 |
1 |
0 |
0 |
0.000 |
| 24 |
31 |
|
[SO4]D:506 |
4 |
1 |
186 |
◊ |
D |
-y+1,-x+1,-z+3/2 |
8_666 |
4 |
3 |
6070 |
41.7 |
-3.8 |
0.944 |
1 |
0 |
0 |
0.116 |
| 25 |
32 |
|
[SO4]B:501 |
4 |
1 |
185 |
◊ |
A |
-y+3/2,x+3/2,z+1/4 |
3_665 |
4 |
1 |
6170 |
41.6 |
-4.7 |
0.877 |
1 |
0 |
0 |
0.000 |
| 26 |
33 |
|
[SO4]D:503 |
4 |
1 |
184 |
◊ |
C |
-y+3/2,x+1/2,z+1/4 |
3_655 |
6 |
1 |
6769 |
40.5 |
-4.2 |
0.935 |
2 |
0 |
0 |
0.000 |
| 27 |
34 |
|
A |
6 |
3 |
6170 |
◊ |
C |
-y+1,-x+2,-z+3/2 |
8_676 |
3 |
2 |
6769 |
35.1 |
1.2 |
0.719 |
0 |
0 |
0 |
0.000 |
| 28 |
35 |
|
D |
5 |
3 |
6070 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
6170 |
31.5 |
-0.4 |
0.478 |
0 |
0 |
0 |
0.002 |
| 29 |
36 |
|
[ACE]H:555 |
2 |
1 |
172 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
6769 |
30.4 |
-0.3 |
0.675 |
0 |
0 |
0 |
0.005 |
| 30 |
37 |
|
[ACE]F:555 |
2 |
1 |
171 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
6753 |
28.8 |
-0.3 |
0.619 |
0 |
0 |
0 |
0.007 |
| 31 |
38 |
|
[SO4]D:506 |
4 |
1 |
186 |
◊ |
[SO4]D:506 |
-y+1,-x+1,-z+3/2 |
8_666 |
4 |
1 |
186 |
25.8 |
-5.4 |
0.998 |
0 |
0 |
0 |
0.073 |
| 32 |
39 |
|
D |
4 |
2 |
6070 |
◊ |
D |
-y+1,-x+1,-z+3/2 |
8_666 |
4 |
2 |
6070 |
25.5 |
0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
| 33 |
40 |
|
E |
3 |
2 |
963 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
6769 |
23.7 |
-0.8 |
0.191 |
0 |
0 |
0 |
0.003 |
| 34 |
41 |
|
G |
4 |
2 |
1002 |
◊ |
C |
-y+3/2,x+1/2,z+1/4 |
3_655 |
3 |
2 |
6769 |
20.5 |
-0.3 |
0.468 |
0 |
0 |
0 |
0.000 |
| 35 |
42 |
|
[SO4]C:502 |
2 |
1 |
187 |
◊ |
A |
-x+1/2,y-1/2,-z+5/4 |
5_546 |
3 |
1 |
6170 |
15.3 |
-1.9 |
0.744 |
0 |
0 |
0 |
0.000 |
| 36 |
43 |
|
F |
3 |
2 |
946 |
◊ |
A |
-y+3/2,x+3/2,z+1/4 |
3_665 |
2 |
1 |
6170 |
15.3 |
-0.2 |
0.440 |
0 |
0 |
0 |
0.000 |
| 37 |
44 |
|
[SO4]C:507 |
1 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
6753 |
8.9 |
-1.1 |
0.709 |
0 |
0 |
0 |
0.013 |
| 38 |
45 |
|
[SO4]B:509 |
1 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
6769 |
8.1 |
-1.0 |
0.718 |
0 |
0 |
0 |
0.012 |
| 39 |
46 |
|
[ACE]G:555 |
1 |
1 |
173 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
6070 |
6.1 |
0.1 |
0.622 |
0 |
0 |
0 |
0.000 |
| 40 |
47 |
|
C |
1 |
1 |
6769 |
◊ |
[SO4]A:500 |
-x+1/2,y-1/2,-z+5/4 |
5_546 |
1 |
1 |
186 |
3.0 |
-0.3 |
0.860 |
0 |
0 |
0 |
0.000 |
|