| ## |
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 |
152 |
45 |
16586 |
◊ |
A |
-x,y,-z |
2_555 |
152 |
45 |
16586 |
1380.8 |
-0.8 |
0.674 |
14 |
18 |
0 |
0.000 |
2 |
|
D |
146 |
44 |
16542 |
◊ |
C |
-x,y,-z+1 |
2_556 |
147 |
45 |
16523 |
1301.8 |
-0.8 |
0.695 |
14 |
18 |
0 |
0.000 |
| Average: |
1341.3 |
-0.8 |
0.685 |
14 |
18 |
0 |
0.000 |
| 2 |
3 |
|
C |
62 |
23 |
16523 |
◊ |
C |
-x,y,-z+1 |
2_556 |
62 |
23 |
16523 |
543.2 |
-6.3 |
0.193 |
2 |
6 |
0 |
0.000 |
4 |
|
B |
55 |
21 |
16132 |
◊ |
A |
x,y,z |
1_555 |
56 |
20 |
16586 |
496.4 |
-6.2 |
0.171 |
2 |
3 |
0 |
0.000 |
| Average: |
519.8 |
-6.3 |
0.182 |
2 |
5 |
0 |
0.000 |
| 3 |
5 |
|
C |
47 |
15 |
16523 |
◊ |
A |
x,y-1,z |
1_545 |
45 |
15 |
16586 |
475.7 |
4.6 |
0.906 |
6 |
8 |
0 |
0.000 |
6 |
|
D |
44 |
15 |
16542 |
◊ |
B |
-x-1/2,y-1/2,-z |
4_445 |
48 |
15 |
16132 |
466.8 |
3.6 |
0.886 |
8 |
7 |
0 |
0.000 |
| Average: |
471.3 |
4.1 |
0.896 |
7 |
8 |
0 |
0.000 |
| 4 |
7 |
|
D |
41 |
15 |
16542 |
◊ |
B |
x,y,z |
1_555 |
43 |
14 |
16132 |
399.1 |
1.3 |
0.752 |
7 |
0 |
0 |
0.000 |
| 5 |
8 |
|
C |
38 |
11 |
16523 |
◊ |
A |
x,y,z |
1_555 |
31 |
7 |
16586 |
285.7 |
-0.6 |
0.537 |
2 |
0 |
0 |
0.000 |
| 6 |
9 |
|
[MLW]B:506 |
16 |
1 |
378 |
f |
B |
x,y,z |
1_555 |
45 |
18 |
16132 |
270.1 |
-1.7 |
0.328 |
0 |
0 |
0 |
0.006 |
10 |
|
[MLW]C:506 |
16 |
1 |
376 |
f |
C |
x,y,z |
1_555 |
43 |
18 |
16523 |
269.0 |
-1.6 |
0.341 |
2 |
0 |
0 |
0.006 |
11 |
|
[MLW]A:507 |
16 |
1 |
374 |
f |
A |
x,y,z |
1_555 |
44 |
19 |
16586 |
268.9 |
-1.8 |
0.317 |
2 |
0 |
0 |
0.006 |
| Average: |
269.3 |
-1.7 |
0.329 |
1 |
0 |
0 |
0.006 |
| 7 |
12 |
|
[PG4]A:502 |
13 |
1 |
411 |
◊ |
A |
x,y,z |
1_555 |
44 |
15 |
16586 |
248.8 |
6.9 |
0.499 |
2 |
0 |
0 |
0.000 |
| 8 |
13 |
|
C |
20 |
7 |
16523 |
f |
[PG4]A:501 |
x,y-1,z |
1_545 |
12 |
1 |
406 |
173.8 |
3.4 |
0.246 |
4 |
0 |
0 |
0.000 |
| 9 |
14 |
|
[PG4]A:501 |
13 |
1 |
406 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
16586 |
173.3 |
5.0 |
0.308 |
4 |
0 |
0 |
0.000 |
| 10 |
15 |
|
[PG4]B:501 |
12 |
1 |
405 |
◊ |
B |
x,y,z |
1_555 |
25 |
9 |
16132 |
172.4 |
4.2 |
0.311 |
1 |
0 |
0 |
0.000 |
| 11 |
16 |
|
[PG4]A:503 |
13 |
1 |
407 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
16586 |
169.8 |
3.2 |
0.224 |
4 |
0 |
0 |
0.000 |
17 |
|
[PG4]C:501 |
13 |
1 |
405 |
◊ |
C |
x,y,z |
1_555 |
23 |
8 |
16523 |
165.3 |
3.6 |
0.227 |
5 |
0 |
0 |
0.000 |
| Average: |
167.6 |
3.4 |
0.225 |
5 |
0 |
0 |
0.000 |
| 12 |
18 |
|
D |
19 |
6 |
16542 |
f |
[PG4]B:501 |
-x-1/2,y-1/2,-z |
4_445 |
12 |
1 |
405 |
166.9 |
3.7 |
0.285 |
3 |
0 |
0 |
0.000 |
| 13 |
19 |
|
[SO4]B:502 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
16132 |
102.1 |
-16.2 |
0.766 |
2 |
0 |
0 |
0.033 |
| 14 |
20 |
|
[SO4]A:505 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
16586 |
102.0 |
-16.5 |
0.745 |
1 |
0 |
0 |
0.037 |
| 15 |
21 |
|
[SO4]C:502 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
14 |
4 |
16523 |
96.1 |
-13.5 |
0.836 |
3 |
0 |
0 |
0.027 |
| 16 |
22 |
|
[SO4]D:501 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
13 |
4 |
16542 |
88.9 |
-12.3 |
0.822 |
4 |
0 |
0 |
0.064 |
| 17 |
23 |
|
[SO4]C:504 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
16523 |
86.5 |
-13.0 |
0.731 |
6 |
0 |
0 |
0.029 |
| 18 |
24 |
|
[SO4]A:504 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
16586 |
85.7 |
-12.8 |
0.701 |
6 |
0 |
0 |
0.034 |
| 19 |
25 |
|
[SO4]C:503 |
4 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
16523 |
75.3 |
-9.9 |
0.784 |
3 |
0 |
0 |
0.021 |
| 20 |
26 |
|
[SO4]B:504 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
16132 |
75.1 |
-10.3 |
0.756 |
2 |
0 |
0 |
0.021 |
| 21 |
27 |
|
[SO4]B:503 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
16132 |
73.3 |
-11.2 |
0.704 |
2 |
0 |
0 |
0.023 |
| 22 |
28 |
|
[SO4]B:505 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
16132 |
72.9 |
-8.8 |
0.908 |
3 |
0 |
0 |
0.019 |
| 23 |
29 |
|
[SO4]A:506 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
16586 |
72.6 |
-9.4 |
0.904 |
2 |
0 |
0 |
0.023 |
| 24 |
30 |
|
[SO4]C:505 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
16523 |
72.6 |
-9.3 |
0.884 |
4 |
0 |
0 |
0.020 |
| 25 |
31 |
|
[SO4]D:502 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
16542 |
71.9 |
-9.6 |
0.887 |
2 |
0 |
0 |
0.047 |
| 26 |
32 |
|
B |
10 |
4 |
16132 |
◊ |
D |
-x-1/2,y-1/2,-z |
4_445 |
7 |
4 |
16542 |
64.0 |
0.6 |
0.729 |
2 |
0 |
0 |
0.000 |
| 27 |
33 |
|
B |
6 |
3 |
16132 |
◊ |
A |
-x,y,-z |
2_555 |
6 |
2 |
16586 |
32.9 |
0.5 |
0.741 |
0 |
0 |
0 |
0.000 |
| 28 |
34 |
|
D |
3 |
1 |
16542 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
16523 |
13.5 |
0.2 |
0.725 |
0 |
0 |
0 |
0.000 |
| 29 |
35 |
|
[PG4]A:502 |
3 |
1 |
411 |
f |
A |
-x,y,-z |
2_555 |
2 |
1 |
16586 |
11.6 |
-0.6 |
0.221 |
0 |
0 |
0 |
0.001 |
| 30 |
36 |
|
[SO4]D:501 |
2 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
16132 |
10.0 |
-1.4 |
0.576 |
0 |
0 |
0 |
0.000 |
| 31 |
37 |
|
[PG4]C:501 |
2 |
1 |
405 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
16586 |
7.1 |
0.6 |
0.426 |
0 |
0 |
0 |
0.000 |
| 32 |
38 |
|
[SO4]C:504 |
1 |
1 |
186 |
f |
[SO4]C:503 |
x,y,z |
1_555 |
1 |
1 |
187 |
2.3 |
-0.6 |
1.000 |
0 |
0 |
0 |
0.001 |
|