## |
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 |
122 |
35 |
17242 |
◊ |
A |
x,y,z |
1_555 |
114 |
35 |
16913 |
1192.4 |
-9.5 |
0.236 |
11 |
6 |
0 |
0.521 |
2 |
|
D |
112 |
33 |
17120 |
◊ |
C |
x,y,z |
1_555 |
102 |
28 |
17481 |
1103.9 |
-6.6 |
0.355 |
11 |
7 |
0 |
0.521 |
Average: |
1148.2 |
-8.0 |
0.296 |
11 |
7 |
0 |
0.521 |
2 |
3 |
|
C |
67 |
22 |
17481 |
◊ |
B |
-y,x-1,z-3/4 |
3_544 |
61 |
21 |
17242 |
566.4 |
-3.5 |
0.375 |
5 |
0 |
0 |
0.000 |
3 |
4 |
|
A |
57 |
16 |
16913 |
◊ |
D |
-y,x,z+1/4 |
3_555 |
49 |
15 |
17120 |
507.9 |
-5.3 |
0.232 |
4 |
1 |
0 |
0.008 |
4 |
5 |
|
B |
52 |
13 |
17242 |
◊ |
C |
-y,x,z+1/4 |
3_555 |
54 |
14 |
17481 |
507.6 |
-5.7 |
0.205 |
1 |
1 |
0 |
0.007 |
5 |
6 |
|
C |
70 |
18 |
17481 |
◊ |
A |
x,y,z |
1_555 |
59 |
15 |
16913 |
500.4 |
-4.3 |
0.359 |
5 |
0 |
0 |
0.122 |
7 |
|
D |
50 |
15 |
17120 |
◊ |
B |
x,y,z |
1_555 |
56 |
14 |
17242 |
427.6 |
-6.5 |
0.152 |
0 |
0 |
0 |
0.122 |
Average: |
464.0 |
-5.4 |
0.255 |
3 |
0 |
0 |
0.122 |
6 |
8 |
|
D |
55 |
14 |
17120 |
◊ |
A |
x,y,z |
1_555 |
57 |
13 |
16913 |
428.4 |
-5.5 |
0.238 |
4 |
0 |
0 |
0.068 |
7 |
9 |
|
A |
30 |
10 |
16913 |
◊ |
B |
-x+1,-y,z-1/2 |
2_654 |
30 |
11 |
17242 |
270.3 |
0.0 |
0.651 |
3 |
0 |
0 |
0.000 |
8 |
10 |
|
[CIT]A:502 |
12 |
1 |
312 |
f |
A |
x,y,z |
1_555 |
42 |
15 |
16913 |
213.0 |
0.7 |
0.454 |
3 |
0 |
0 |
0.023 |
9 |
11 |
|
A |
29 |
10 |
16913 |
◊ |
D |
-y,x,z-3/4 |
3_554 |
23 |
7 |
17120 |
196.1 |
-0.9 |
0.503 |
1 |
2 |
0 |
0.000 |
10 |
12 |
|
[SNN]A:176 |
7 |
1 |
245 |
cf |
A |
x,y,z |
1_555 |
10 |
6 |
16913 |
127.0 |
1.3 |
0.293 |
1 |
0 |
0 |
0.000 |
13 |
|
[SNN]C:176 |
7 |
1 |
243 |
cf |
C |
x,y,z |
1_555 |
9 |
6 |
17481 |
126.4 |
1.4 |
0.278 |
1 |
0 |
0 |
0.000 |
14 |
|
[SNN]B:176 |
7 |
1 |
245 |
cf |
B |
x,y,z |
1_555 |
10 |
6 |
17242 |
126.2 |
1.4 |
0.295 |
1 |
0 |
0 |
0.000 |
15 |
|
[SNN]D:176 |
7 |
1 |
244 |
cf |
D |
x,y,z |
1_555 |
9 |
5 |
17120 |
125.8 |
1.4 |
0.277 |
1 |
0 |
0 |
0.000 |
Average: |
126.3 |
1.4 |
0.286 |
1 |
0 |
0 |
0.000 |
11 |
16 |
|
B |
16 |
8 |
17242 |
◊ |
D |
-y,x,z+1/4 |
3_555 |
14 |
7 |
17120 |
122.2 |
-0.8 |
0.491 |
1 |
0 |
0 |
0.001 |
12 |
17 |
|
[SO4]C:501 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
18 |
7 |
17481 |
84.4 |
-12.6 |
0.678 |
2 |
0 |
0 |
0.127 |
13 |
18 |
|
[SO4]D:501 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
16 |
7 |
17120 |
81.4 |
-11.8 |
0.661 |
3 |
0 |
0 |
0.124 |
14 |
19 |
|
[SO4]B:502 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
3 |
17242 |
67.1 |
-6.4 |
0.966 |
2 |
0 |
0 |
0.248 |
15 |
20 |
|
D |
9 |
4 |
17120 |
x |
D |
-y,x,z+1/4 |
3_555 |
7 |
2 |
17120 |
64.7 |
-0.5 |
0.483 |
0 |
0 |
0 |
0.000 |
16 |
21 |
|
[SO4]A:501 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
17481 |
56.7 |
-7.7 |
0.540 |
1 |
0 |
0 |
0.077 |
17 |
22 |
|
[SO4]B:501 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
17242 |
53.8 |
-7.4 |
0.587 |
1 |
0 |
0 |
0.268 |
18 |
23 |
|
[SO4]B:501 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
17120 |
49.7 |
-4.8 |
0.963 |
2 |
0 |
0 |
0.054 |
19 |
24 |
|
[SO4]A:501 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
16913 |
48.5 |
-5.6 |
0.819 |
0 |
0 |
0 |
0.053 |
20 |
25 |
|
C |
5 |
3 |
17481 |
x |
C |
-y,x-1,z+1/4 |
3_545 |
3 |
2 |
17481 |
35.4 |
0.6 |
0.732 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
A |
4 |
2 |
16913 |
◊ |
C |
-y,x,z+1/4 |
3_555 |
2 |
1 |
17481 |
15.5 |
0.2 |
0.722 |
0 |
0 |
0 |
0.000 |
|