| ## |
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 |
161 |
42 |
12002 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
160 |
42 |
12002 |
1535.6 |
-21.7 |
0.091 |
6 |
0 |
0 |
0.418 |
2 |
|
D |
146 |
38 |
12131 |
◊ |
C |
x,y,z |
1_555 |
144 |
37 |
10939 |
1479.8 |
-21.3 |
0.065 |
14 |
4 |
0 |
0.418 |
| Average: |
1507.7 |
-21.5 |
0.078 |
10 |
2 |
0 |
0.418 |
| 2 |
3 |
|
D |
108 |
28 |
12131 |
◊ |
D |
-x,y,-z+3/2 |
3_556 |
108 |
28 |
12131 |
1019.4 |
-9.3 |
0.361 |
6 |
2 |
0 |
0.027 |
| 3 |
4 |
|
A |
63 |
18 |
12002 |
x |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
58 |
16 |
12002 |
588.0 |
-1.1 |
0.699 |
9 |
2 |
0 |
0.000 |
| 4 |
5 |
|
[GTS]A:230 |
23 |
1 |
532 |
f |
A |
x,y,z |
1_555 |
48 |
15 |
12002 |
364.3 |
-0.5 |
0.656 |
9 |
0 |
0 |
0.130 |
6 |
|
[GTS]C:240 |
23 |
1 |
528 |
f |
C |
x,y,z |
1_555 |
39 |
13 |
10939 |
304.8 |
0.5 |
0.703 |
9 |
0 |
0 |
0.130 |
7 |
|
[GTS]D:250 |
23 |
1 |
524 |
f |
D |
x,y,z |
1_555 |
36 |
11 |
12131 |
299.2 |
0.5 |
0.709 |
10 |
0 |
0 |
0.130 |
| Average: |
322.7 |
0.1 |
0.690 |
9 |
0 |
0 |
0.130 |
| 5 |
8 |
|
C |
34 |
13 |
10939 |
◊ |
C |
x,-y+1,-z+1 |
4_566 |
34 |
13 |
10939 |
340.5 |
1.9 |
0.840 |
6 |
0 |
0 |
0.000 |
| 6 |
9 |
|
C |
33 |
9 |
10939 |
◊ |
C |
-x,y,-z+1/2 |
3_555 |
33 |
9 |
10939 |
291.9 |
-5.0 |
0.229 |
2 |
2 |
0 |
0.000 |
| 7 |
10 |
|
A |
36 |
16 |
12002 |
◊ |
D |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
26 |
9 |
12131 |
286.3 |
-0.8 |
0.618 |
3 |
2 |
0 |
0.000 |
| 8 |
11 |
|
D |
28 |
9 |
12131 |
◊ |
A |
x,y,z |
1_555 |
32 |
10 |
12002 |
270.5 |
-4.4 |
0.252 |
2 |
2 |
0 |
0.000 |
| 9 |
12 |
|
C |
24 |
11 |
10939 |
◊ |
C |
-x+1,y,-z+1/2 |
3_655 |
24 |
11 |
10939 |
199.6 |
3.2 |
0.912 |
2 |
0 |
0 |
0.000 |
| 10 |
13 |
|
D |
21 |
7 |
12131 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
15 |
4 |
12002 |
150.3 |
-1.2 |
0.452 |
0 |
0 |
0 |
0.000 |
14 |
|
C |
5 |
3 |
10939 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
12002 |
43.8 |
-0.0 |
0.585 |
0 |
0 |
0 |
0.000 |
15 |
|
D |
1 |
1 |
12131 |
◊ |
C |
-x,y,-z+1/2 |
3_555 |
2 |
1 |
10939 |
14.3 |
-0.0 |
0.377 |
0 |
0 |
0 |
0.000 |
| Average: |
69.5 |
-0.4 |
0.471 |
0 |
0 |
0 |
0.000 |
| 11 |
16 |
|
[GTS]A:230 |
8 |
1 |
532 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
9 |
4 |
12002 |
84.8 |
0.4 |
0.560 |
5 |
0 |
0 |
0.054 |
17 |
|
[GTS]C:240 |
8 |
1 |
528 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
12131 |
80.5 |
0.3 |
0.553 |
3 |
0 |
0 |
0.054 |
18 |
|
[GTS]D:250 |
7 |
1 |
524 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
10939 |
71.9 |
0.6 |
0.603 |
2 |
0 |
0 |
0.054 |
| Average: |
79.0 |
0.4 |
0.572 |
3 |
0 |
0 |
0.054 |
| 12 |
19 |
|
[SO4]A:260 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
12002 |
79.2 |
-11.1 |
0.811 |
3 |
0 |
0 |
0.361 |
| 13 |
20 |
|
[SO4]D:262 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
12131 |
75.3 |
-11.6 |
0.603 |
2 |
0 |
0 |
0.185 |
| 14 |
21 |
|
[SO4]C:261 |
5 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
10939 |
71.3 |
-10.1 |
0.761 |
2 |
0 |
0 |
0.163 |
| 15 |
22 |
|
[SO4]D:262 |
1 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
10939 |
25.9 |
-3.7 |
0.262 |
0 |
0 |
0 |
0.055 |
| 16 |
23 |
|
[SO4]A:260 |
1 |
1 |
183 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
1 |
1 |
12002 |
24.6 |
-3.5 |
0.277 |
0 |
0 |
0 |
0.102 |
| 17 |
24 |
|
[SO4]C:261 |
3 |
1 |
183 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
12131 |
23.5 |
-3.2 |
0.299 |
0 |
0 |
0 |
0.047 |
| 18 |
25 |
|
D |
3 |
2 |
12131 |
◊ |
C |
x,-y+1,-z+1 |
4_566 |
3 |
2 |
10939 |
17.5 |
0.1 |
0.620 |
0 |
0 |
0 |
0.000 |
| 19 |
26 |
|
A |
1 |
1 |
12002 |
◊ |
C |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
2 |
1 |
10939 |
15.0 |
0.7 |
0.895 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
A |
2 |
1 |
12002 |
◊ |
D |
x-1/2,-y+1/2,-z+1 |
8_456 |
2 |
1 |
12131 |
14.0 |
-0.4 |
0.326 |
0 |
0 |
0 |
0.000 |
| 21 |
28 |
|
[GTS]A:230 |
3 |
1 |
532 |
◊ |
D |
-x,y,-z+1/2 |
3_555 |
1 |
1 |
12131 |
4.8 |
0.1 |
0.654 |
0 |
0 |
0 |
0.000 |
| 22 |
29 |
|
A |
1 |
1 |
12002 |
x |
A |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
12002 |
1.8 |
0.0 |
0.621 |
0 |
0 |
0 |
0.000 |
|