| ## |
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 |
|
F |
173 |
39 |
10639 |
◊ |
E |
x,y,z |
1_555 |
170 |
39 |
10616 |
1599.6 |
-25.5 |
0.012 |
8 |
8 |
0 |
1.000 |
2 |
|
D |
169 |
39 |
10616 |
◊ |
A |
x,y,z |
1_555 |
165 |
39 |
10571 |
1576.7 |
-24.2 |
0.019 |
8 |
8 |
0 |
1.000 |
3 |
|
C |
166 |
38 |
10672 |
◊ |
B |
x,y,z |
1_555 |
166 |
38 |
10861 |
1568.9 |
-25.1 |
0.010 |
8 |
8 |
0 |
1.000 |
| Average: |
1581.7 |
-24.9 |
0.014 |
8 |
8 |
0 |
1.000 |
| 2 |
4 |
|
F |
164 |
40 |
10639 |
◊ |
F |
x,-y,-z-1 |
4_554 |
164 |
40 |
10639 |
1501.2 |
-15.5 |
0.161 |
6 |
10 |
0 |
1.000 |
5 |
|
D |
160 |
40 |
10616 |
◊ |
C |
x,y,z |
1_555 |
163 |
39 |
10672 |
1488.7 |
-16.7 |
0.125 |
12 |
9 |
0 |
1.000 |
6 |
|
E |
162 |
40 |
10616 |
◊ |
E |
x,-y,-z-1 |
4_554 |
162 |
40 |
10616 |
1473.5 |
-16.1 |
0.129 |
6 |
8 |
0 |
1.000 |
7 |
|
B |
164 |
40 |
10861 |
◊ |
A |
x,y,z |
1_555 |
162 |
40 |
10571 |
1471.4 |
-15.6 |
0.146 |
12 |
11 |
0 |
1.000 |
| Average: |
1483.7 |
-16.0 |
0.141 |
9 |
10 |
0 |
1.000 |
| 3 |
8 |
|
E |
73 |
20 |
10616 |
◊ |
B |
x,y,z |
1_555 |
50 |
17 |
10861 |
557.7 |
-3.9 |
0.420 |
3 |
6 |
0 |
0.132 |
| 4 |
9 |
|
D |
37 |
9 |
10616 |
◊ |
B |
x,y,z |
1_555 |
36 |
9 |
10861 |
301.0 |
1.1 |
0.790 |
3 |
1 |
0 |
0.000 |
10 |
|
C |
38 |
8 |
10672 |
◊ |
A |
x,y,z |
1_555 |
36 |
10 |
10571 |
298.4 |
3.1 |
0.896 |
2 |
1 |
0 |
0.000 |
11 |
|
F |
34 |
8 |
10639 |
◊ |
E |
x,-y,-z-1 |
4_554 |
32 |
9 |
10616 |
280.5 |
1.1 |
0.780 |
1 |
0 |
0 |
0.000 |
| Average: |
293.3 |
1.8 |
0.822 |
2 |
1 |
0 |
0.000 |
| 5 |
12 |
|
E |
26 |
7 |
10616 |
◊ |
B |
-x-1,y,-z-1/2 |
3_454 |
29 |
9 |
10861 |
226.8 |
1.6 |
0.786 |
0 |
1 |
0 |
0.000 |
| 6 |
13 |
|
C |
26 |
8 |
10672 |
◊ |
D |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
27 |
8 |
10616 |
221.4 |
-0.4 |
0.620 |
0 |
0 |
0 |
0.000 |
| 7 |
14 |
|
[4SD]D:301 |
8 |
1 |
276 |
f |
D |
x,y,z |
1_555 |
30 |
13 |
10616 |
178.7 |
4.2 |
0.489 |
0 |
0 |
0 |
0.000 |
15 |
|
[4SD]A:301 |
8 |
1 |
274 |
f |
A |
x,y,z |
1_555 |
31 |
13 |
10571 |
178.6 |
4.2 |
0.524 |
0 |
0 |
0 |
0.000 |
16 |
|
[4SD]F:301 |
8 |
1 |
271 |
f |
F |
x,y,z |
1_555 |
29 |
13 |
10639 |
176.6 |
4.3 |
0.483 |
0 |
0 |
0 |
0.000 |
| Average: |
178.0 |
4.2 |
0.499 |
0 |
0 |
0 |
0.000 |
| 8 |
17 |
|
C |
20 |
8 |
10672 |
◊ |
D |
x-1/2,-y+1/2,-z |
8_455 |
14 |
5 |
10616 |
176.2 |
3.4 |
0.932 |
0 |
5 |
0 |
0.000 |
| 9 |
18 |
|
[4SD]B:301 |
8 |
1 |
274 |
f |
B |
x,y,z |
1_555 |
28 |
13 |
10861 |
175.7 |
4.3 |
0.515 |
0 |
0 |
0 |
0.000 |
| 10 |
19 |
|
[4SD]C:301 |
8 |
1 |
276 |
f |
C |
x,y,z |
1_555 |
29 |
13 |
10672 |
174.7 |
4.4 |
0.479 |
1 |
0 |
0 |
0.000 |
| 11 |
20 |
|
[4SD]E:301 |
8 |
1 |
273 |
f |
E |
x,y,z |
1_555 |
28 |
13 |
10616 |
174.5 |
4.2 |
0.485 |
1 |
0 |
0 |
0.000 |
| 12 |
21 |
|
[4SD]B:302 |
8 |
1 |
280 |
◊ |
B |
x,y,z |
1_555 |
23 |
5 |
10861 |
139.9 |
2.6 |
0.134 |
0 |
0 |
0 |
0.000 |
| 13 |
22 |
|
C |
15 |
5 |
10672 |
◊ |
A |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
11 |
4 |
10571 |
128.7 |
-1.4 |
0.393 |
0 |
1 |
0 |
0.000 |
23 |
|
B |
10 |
4 |
10861 |
◊ |
D |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
16 |
5 |
10616 |
121.7 |
-0.0 |
0.527 |
1 |
2 |
0 |
0.000 |
| Average: |
125.2 |
-0.7 |
0.460 |
1 |
2 |
0 |
0.000 |
| 14 |
24 |
|
F |
13 |
3 |
10639 |
◊ |
F |
-x,y,-z-1/2 |
3_554 |
13 |
3 |
10639 |
127.7 |
1.4 |
0.832 |
0 |
0 |
0 |
0.000 |
| 15 |
25 |
|
E |
11 |
4 |
10616 |
◊ |
E |
-x-1,y,-z-1/2 |
3_454 |
11 |
4 |
10616 |
108.4 |
1.4 |
0.848 |
0 |
4 |
0 |
0.000 |
| 16 |
26 |
|
[4SD]B:302 |
8 |
1 |
280 |
f |
E |
x,y,z |
1_555 |
14 |
4 |
10616 |
82.8 |
0.4 |
0.005 |
0 |
0 |
0 |
0.000 |
| 17 |
27 |
|
C |
7 |
3 |
10672 |
◊ |
C |
-x-1,y,-z-1/2 |
3_454 |
7 |
3 |
10672 |
55.3 |
0.5 |
0.749 |
0 |
0 |
0 |
0.000 |
| 18 |
28 |
|
F |
7 |
2 |
10639 |
◊ |
A |
-x,-y,z-1/2 |
2_554 |
5 |
1 |
10571 |
55.1 |
1.2 |
0.861 |
0 |
0 |
0 |
0.000 |
| 19 |
29 |
|
E |
6 |
3 |
10616 |
◊ |
B |
-x-1,-y,z-1/2 |
2_454 |
10 |
4 |
10861 |
53.1 |
1.1 |
0.818 |
0 |
0 |
0 |
0.000 |
| 20 |
30 |
|
[SO4]A:302 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
10571 |
47.6 |
-6.1 |
0.827 |
0 |
0 |
0 |
0.331 |
| 21 |
31 |
|
[SO4]A:302 |
4 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
7 |
3 |
10616 |
45.9 |
-5.6 |
0.851 |
0 |
0 |
0 |
0.105 |
| 22 |
32 |
|
[MG]E:302 |
1 |
1 |
98 |
f |
[MG]E:302 |
-x-1,y,-z-1/2 |
3_454 |
1 |
1 |
98 |
45.9 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.597 |
| 23 |
33 |
|
F |
7 |
2 |
10639 |
◊ |
C |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
7 |
2 |
10672 |
44.8 |
0.5 |
0.726 |
0 |
0 |
0 |
0.000 |
| 24 |
34 |
|
[MG]E:302 |
1 |
1 |
98 |
x |
E |
x,y,z |
1_555 |
7 |
4 |
10616 |
34.5 |
-3.9 |
0.000 |
0 |
0 |
0 |
1.000 |
| 25 |
35 |
|
F |
8 |
3 |
10639 |
◊ |
A |
x,-y,-z |
4_555 |
5 |
3 |
10571 |
27.3 |
-0.2 |
0.543 |
0 |
0 |
0 |
0.000 |
| 26 |
36 |
|
F |
3 |
2 |
10639 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
5 |
3 |
10571 |
25.3 |
-0.5 |
0.384 |
0 |
0 |
0 |
0.000 |
| 27 |
37 |
|
D |
2 |
2 |
10616 |
◊ |
C |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
3 |
2 |
10672 |
25.1 |
1.6 |
0.952 |
0 |
0 |
0 |
0.000 |
| 28 |
38 |
|
[SO4]A:302 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
10861 |
22.5 |
-1.7 |
0.975 |
0 |
0 |
0 |
0.078 |
| 29 |
39 |
|
B |
1 |
1 |
10861 |
◊ |
B |
x,-y,-z |
4_555 |
1 |
1 |
10861 |
17.7 |
0.4 |
0.886 |
0 |
0 |
0 |
0.000 |
| 30 |
40 |
|
F |
1 |
1 |
10639 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
10571 |
16.1 |
0.0 |
0.626 |
0 |
0 |
0 |
0.000 |
| 31 |
41 |
|
D |
2 |
1 |
10616 |
◊ |
D |
-x,y,-z-1/2 |
3_554 |
2 |
1 |
10616 |
14.9 |
0.3 |
0.785 |
0 |
0 |
0 |
0.000 |
| 32 |
42 |
|
A |
3 |
2 |
10571 |
◊ |
A |
x,-y,-z |
4_555 |
3 |
2 |
10571 |
10.5 |
0.1 |
0.700 |
0 |
0 |
0 |
0.000 |
|