| ## |
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 |
86 |
25 |
10944 |
◊ |
A |
x,y,z |
1_555 |
94 |
26 |
11003 |
898.6 |
-2.7 |
0.319 |
8 |
0 |
0 |
0.112 |
2 |
|
F |
85 |
25 |
10821 |
◊ |
D |
x,y,z |
1_555 |
80 |
25 |
10901 |
860.8 |
-4.7 |
0.225 |
6 |
1 |
0 |
0.112 |
| Average: |
879.7 |
-3.7 |
0.272 |
7 |
1 |
0 |
0.112 |
| 2 |
3 |
|
B |
78 |
22 |
10903 |
◊ |
A |
x,y,z |
1_555 |
78 |
21 |
11003 |
753.7 |
-2.5 |
0.313 |
16 |
0 |
0 |
0.166 |
4 |
|
F |
75 |
21 |
10821 |
◊ |
C |
x,y,z |
1_555 |
74 |
21 |
10944 |
735.0 |
-3.8 |
0.264 |
16 |
0 |
0 |
0.166 |
5 |
|
E |
72 |
20 |
10693 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
73 |
21 |
10901 |
728.2 |
-3.9 |
0.275 |
13 |
0 |
0 |
0.166 |
| Average: |
739.0 |
-3.4 |
0.284 |
15 |
0 |
0 |
0.166 |
| 3 |
6 |
|
E |
50 |
18 |
10693 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
48 |
17 |
10903 |
442.0 |
-4.2 |
0.187 |
4 |
0 |
0 |
0.000 |
| 4 |
7 |
|
E |
21 |
5 |
10693 |
◊ |
F |
x,y-1,z |
1_545 |
20 |
7 |
10821 |
199.6 |
1.1 |
0.693 |
4 |
4 |
0 |
0.000 |
| 5 |
8 |
|
C |
17 |
7 |
10944 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
28 |
10 |
10903 |
198.2 |
2.4 |
0.787 |
5 |
0 |
0 |
0.000 |
| 6 |
9 |
|
E |
20 |
6 |
10693 |
x |
F |
x-1,y-1,z |
1_445 |
19 |
7 |
10821 |
181.9 |
0.7 |
0.647 |
3 |
1 |
0 |
0.000 |
10 |
|
A |
17 |
5 |
11003 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
18 |
6 |
11003 |
172.0 |
0.2 |
0.540 |
2 |
1 |
0 |
0.000 |
| Average: |
177.0 |
0.5 |
0.593 |
3 |
1 |
0 |
0.000 |
| 7 |
11 |
|
[SO4]A:302 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
11003 |
90.9 |
-10.1 |
0.852 |
2 |
0 |
0 |
0.165 |
| 8 |
12 |
|
[SO4]C:301 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
14 |
8 |
10944 |
90.6 |
-10.8 |
0.827 |
3 |
0 |
0 |
0.181 |
| 9 |
13 |
|
[SO4]D:302 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
14 |
7 |
10821 |
89.8 |
-11.0 |
0.691 |
3 |
0 |
0 |
0.184 |
| 10 |
14 |
|
[SO4]F:302 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
15 |
7 |
10901 |
88.5 |
-10.3 |
0.831 |
3 |
0 |
0 |
0.200 |
| 11 |
15 |
|
B |
7 |
3 |
10903 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
13 |
6 |
10944 |
87.9 |
1.7 |
0.829 |
2 |
1 |
0 |
0.000 |
| 12 |
16 |
|
[SO4]B:302 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
10903 |
77.6 |
-11.5 |
0.668 |
2 |
0 |
0 |
0.177 |
| 13 |
17 |
|
E |
11 |
5 |
10693 |
f |
[SO4]D:301 |
-x,y-1/2,-z-1/2 |
3_544 |
5 |
1 |
185 |
76.5 |
-10.7 |
0.798 |
3 |
0 |
0 |
0.207 |
| 14 |
18 |
|
[SO4]C:302 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
10944 |
75.7 |
-10.8 |
0.775 |
4 |
0 |
0 |
0.187 |
| 15 |
19 |
|
[SO4]F:301 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
11 |
5 |
10821 |
74.6 |
-10.3 |
0.796 |
3 |
0 |
0 |
0.174 |
| 16 |
20 |
|
[SO4]B:301 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
10903 |
74.5 |
-10.2 |
0.816 |
3 |
0 |
0 |
0.164 |
| 17 |
21 |
|
[SO4]A:301 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
11003 |
73.7 |
-10.5 |
0.779 |
3 |
0 |
0 |
0.176 |
| 18 |
22 |
|
[SO4]E:301 |
4 |
1 |
186 |
f |
D |
-x,y-1/2,-z-1/2 |
3_544 |
11 |
5 |
10901 |
67.8 |
-9.1 |
0.783 |
2 |
0 |
0 |
0.172 |
| 19 |
23 |
|
A |
6 |
3 |
11003 |
x |
A |
x-1,y,z |
1_455 |
9 |
3 |
11003 |
63.5 |
2.7 |
0.910 |
3 |
3 |
0 |
0.000 |
24 |
|
E |
5 |
2 |
10693 |
x |
E |
x-1,y,z |
1_455 |
4 |
2 |
10693 |
38.0 |
1.7 |
0.873 |
3 |
3 |
0 |
0.000 |
25 |
|
F |
6 |
3 |
10821 |
x |
F |
x-1,y,z |
1_455 |
7 |
3 |
10821 |
35.8 |
0.4 |
0.665 |
0 |
0 |
0 |
0.000 |
| Average: |
45.7 |
1.6 |
0.816 |
2 |
2 |
0 |
0.000 |
| 20 |
26 |
|
D |
10 |
6 |
10901 |
x |
D |
x-1,y,z |
1_455 |
7 |
3 |
10901 |
63.0 |
1.2 |
0.793 |
1 |
0 |
0 |
0.000 |
27 |
|
C |
10 |
6 |
10944 |
x |
C |
x-1,y,z |
1_455 |
10 |
5 |
10944 |
53.1 |
0.8 |
0.674 |
0 |
0 |
0 |
0.000 |
28 |
|
B |
5 |
4 |
10903 |
x |
B |
x-1,y,z |
1_455 |
7 |
4 |
10903 |
23.3 |
0.4 |
0.668 |
0 |
0 |
0 |
0.000 |
| Average: |
46.5 |
0.8 |
0.712 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
D |
6 |
2 |
10901 |
◊ |
F |
-x+1,y-1/2,-z-1/2 |
3_644 |
9 |
2 |
10821 |
62.9 |
-0.6 |
0.386 |
1 |
0 |
0 |
0.000 |
30 |
|
A |
6 |
1 |
11003 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
8 |
2 |
10903 |
49.3 |
-0.8 |
0.310 |
0 |
0 |
0 |
0.000 |
| Average: |
56.1 |
-0.7 |
0.348 |
1 |
0 |
0 |
0.000 |
| 22 |
31 |
|
[SO4]D:301 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
10901 |
60.9 |
-6.6 |
0.875 |
1 |
0 |
0 |
0.122 |
| 23 |
32 |
|
[SO4]F:301 |
4 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
10944 |
60.3 |
-7.2 |
0.756 |
1 |
0 |
0 |
0.102 |
| 24 |
33 |
|
[SO4]E:301 |
4 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
6 |
2 |
10693 |
59.5 |
-7.3 |
0.840 |
1 |
0 |
0 |
0.133 |
| 25 |
34 |
|
[SO4]B:301 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
11003 |
58.1 |
-6.9 |
0.797 |
2 |
0 |
0 |
0.111 |
| 26 |
35 |
|
D |
10 |
5 |
10901 |
◊ |
F |
-x,y-1/2,-z-1/2 |
3_544 |
10 |
5 |
10821 |
57.6 |
0.7 |
0.686 |
0 |
0 |
0 |
0.000 |
36 |
|
E |
7 |
3 |
10693 |
◊ |
C |
x-1,y-1,z |
1_445 |
12 |
4 |
10944 |
49.1 |
0.7 |
0.660 |
0 |
0 |
0 |
0.000 |
37 |
|
B |
1 |
1 |
10903 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
11003 |
12.4 |
0.3 |
0.819 |
0 |
0 |
0 |
0.000 |
| Average: |
39.7 |
0.6 |
0.722 |
0 |
0 |
0 |
0.000 |
| 27 |
38 |
|
[SO4]C:302 |
5 |
1 |
184 |
◊ |
F |
x,y,z |
1_555 |
6 |
2 |
10821 |
56.0 |
-6.6 |
0.801 |
1 |
0 |
0 |
0.095 |
| 28 |
39 |
|
[SO4]F:302 |
4 |
1 |
186 |
◊ |
F |
x,y,z |
1_555 |
7 |
2 |
10821 |
53.7 |
-6.5 |
0.831 |
1 |
0 |
0 |
0.104 |
| 29 |
40 |
|
[SO4]D:302 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
10901 |
53.3 |
-6.4 |
0.806 |
1 |
0 |
0 |
0.102 |
| 30 |
41 |
|
[SO4]A:302 |
5 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
10944 |
52.8 |
-5.2 |
0.938 |
2 |
0 |
0 |
0.092 |
| 31 |
42 |
|
[SO4]C:301 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
11003 |
52.7 |
-6.6 |
0.788 |
1 |
0 |
0 |
0.106 |
| 32 |
43 |
|
[SO4]A:301 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
10903 |
51.3 |
-5.6 |
0.844 |
1 |
0 |
0 |
0.086 |
| 33 |
44 |
|
D |
8 |
3 |
10901 |
x |
D |
-x+1,y-1/2,-z-1/2 |
3_644 |
7 |
3 |
10901 |
45.1 |
1.1 |
0.785 |
1 |
0 |
0 |
0.000 |
| 34 |
45 |
|
A |
4 |
2 |
11003 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
10903 |
24.7 |
0.8 |
0.775 |
1 |
1 |
0 |
0.000 |
| 35 |
46 |
|
E |
2 |
1 |
10693 |
◊ |
C |
x,y-1,z |
1_545 |
4 |
2 |
10944 |
23.7 |
0.2 |
0.630 |
1 |
0 |
0 |
0.000 |
| 36 |
47 |
|
C |
2 |
2 |
10944 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
10903 |
13.3 |
0.7 |
0.849 |
0 |
0 |
0 |
0.000 |
| 37 |
48 |
|
D |
2 |
2 |
10901 |
x |
D |
-x,y-1/2,-z-1/2 |
3_544 |
4 |
2 |
10901 |
10.8 |
0.4 |
0.755 |
0 |
0 |
0 |
0.000 |
|