## |
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 |
180 |
52 |
16776 |
◊ |
A |
x,y,z |
1_555 |
159 |
41 |
16868 |
1572.4 |
-17.5 |
0.186 |
31 |
6 |
0 |
1.000 |
2 |
|
C |
153 |
40 |
16776 |
◊ |
B |
x,y,z |
1_555 |
183 |
54 |
16690 |
1565.8 |
-17.6 |
0.161 |
29 |
6 |
0 |
1.000 |
3 |
|
B |
154 |
39 |
16690 |
◊ |
A |
x,y,z |
1_555 |
182 |
53 |
16868 |
1556.0 |
-17.1 |
0.188 |
30 |
6 |
0 |
1.000 |
Average: |
1564.7 |
-17.4 |
0.178 |
30 |
6 |
0 |
1.000 |
2 |
4 |
|
B |
60 |
18 |
16690 |
◊ |
C |
-x+1/2,y-1/2,-z |
3_545 |
50 |
15 |
16776 |
492.3 |
-1.3 |
0.638 |
2 |
0 |
0 |
0.000 |
3 |
5 |
|
C |
35 |
12 |
16776 |
◊ |
A |
x,y,z-1 |
1_554 |
29 |
10 |
16868 |
322.1 |
-5.6 |
0.077 |
1 |
0 |
0 |
0.000 |
4 |
6 |
|
C |
32 |
10 |
16776 |
◊ |
B |
-x,-y,z |
2_555 |
35 |
10 |
16690 |
294.3 |
3.3 |
0.959 |
5 |
1 |
0 |
0.000 |
7 |
|
A |
29 |
10 |
16868 |
◊ |
A |
-x,-y,z |
2_555 |
28 |
10 |
16868 |
253.5 |
1.1 |
0.865 |
4 |
0 |
0 |
0.000 |
Average: |
273.9 |
2.2 |
0.912 |
5 |
1 |
0 |
0.000 |
5 |
8 |
|
[D12]C:1352 |
11 |
1 |
405 |
◊ |
C |
x,y,z |
1_555 |
39 |
14 |
16776 |
221.2 |
4.0 |
0.174 |
0 |
0 |
0 |
0.000 |
6 |
9 |
|
[D12]C:1357 |
9 |
1 |
352 |
◊ |
A |
x,y,z-1 |
1_554 |
36 |
12 |
16868 |
202.8 |
6.5 |
0.186 |
0 |
0 |
0 |
0.000 |
7 |
10 |
|
[D12]C:1351 |
10 |
1 |
379 |
◊ |
C |
x,y,z |
1_555 |
33 |
11 |
16776 |
194.4 |
5.2 |
0.497 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
[D12]C:1349 |
8 |
1 |
326 |
◊ |
C |
x,y,z |
1_555 |
26 |
10 |
16776 |
163.8 |
4.9 |
0.503 |
0 |
0 |
0 |
0.000 |
9 |
12 |
|
[D12]C:1354 |
9 |
1 |
353 |
f |
C |
x,y,z |
1_555 |
28 |
8 |
16776 |
159.0 |
5.2 |
0.602 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
[D12]C:1348 |
10 |
1 |
382 |
f |
B |
x,y,z-1 |
1_554 |
28 |
10 |
16690 |
148.6 |
4.3 |
0.653 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[D12]C:1355 |
6 |
1 |
270 |
f |
B |
x,y,z-1 |
1_554 |
25 |
8 |
16690 |
134.9 |
3.9 |
0.552 |
0 |
0 |
0 |
0.000 |
12 |
15 |
|
[D12]C:1358 |
7 |
1 |
295 |
◊ |
B |
x,y,z-1 |
1_554 |
26 |
8 |
16690 |
132.2 |
4.7 |
0.806 |
0 |
0 |
0 |
0.000 |
13 |
16 |
|
[D12]C:1348 |
10 |
1 |
382 |
◊ |
C |
x,y,z |
1_555 |
18 |
6 |
16776 |
111.8 |
3.2 |
0.638 |
0 |
0 |
0 |
0.000 |
14 |
17 |
|
[D12]C:1356 |
8 |
1 |
324 |
f |
B |
x,y,z-1 |
1_554 |
12 |
5 |
16690 |
107.7 |
2.3 |
0.295 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
[D12]C:1350 |
7 |
1 |
297 |
◊ |
C |
x,y,z |
1_555 |
18 |
5 |
16776 |
102.6 |
3.0 |
0.677 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
[D12]C:1350 |
7 |
1 |
297 |
◊ |
B |
x,y,z-1 |
1_554 |
14 |
4 |
16690 |
98.1 |
2.6 |
0.426 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[D12]C:1358 |
6 |
1 |
295 |
f |
A |
x,y,z-1 |
1_554 |
12 |
4 |
16868 |
80.3 |
1.9 |
0.441 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
C |
12 |
5 |
16776 |
◊ |
B |
x,y,z-1 |
1_554 |
14 |
5 |
16690 |
78.2 |
-0.3 |
0.634 |
0 |
0 |
0 |
0.000 |
19 |
22 |
|
[D12]C:1353 |
4 |
1 |
213 |
f |
C |
x,y,z |
1_555 |
12 |
4 |
16776 |
78.1 |
2.6 |
0.735 |
0 |
0 |
0 |
0.000 |
20 |
23 |
|
B |
6 |
2 |
16690 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
8 |
2 |
16868 |
64.4 |
0.3 |
0.624 |
1 |
0 |
0 |
0.000 |
21 |
24 |
|
[D12]C:1350 |
7 |
1 |
297 |
◊ |
[D12]C:1348 |
x,y,z |
1_555 |
6 |
1 |
382 |
63.0 |
4.2 |
1.000 |
0 |
0 |
0 |
0.000 |
22 |
25 |
|
[D12]C:1349 |
4 |
1 |
326 |
f |
A |
x,y,z-1 |
1_554 |
10 |
2 |
16868 |
53.8 |
1.7 |
0.807 |
0 |
0 |
0 |
0.000 |
23 |
26 |
|
[CL]B:1348 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
16690 |
49.1 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.198 |
27 |
|
[CL]B:1348 |
1 |
1 |
125 |
◊ |
C |
-x,-y,z |
2_555 |
11 |
4 |
16776 |
48.3 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.198 |
Average: |
48.7 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.198 |
24 |
28 |
|
[MG]A:1347 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
16868 |
49.0 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.836 |
29 |
|
[MG]C:1347 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
6 |
16776 |
48.2 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.836 |
30 |
|
[MG]B:1347 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
6 |
16690 |
47.9 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.836 |
Average: |
48.4 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.836 |
25 |
31 |
|
[D12]C:1351 |
6 |
1 |
379 |
f |
A |
x,y,z-1 |
1_554 |
6 |
2 |
16868 |
42.6 |
1.3 |
0.822 |
0 |
0 |
0 |
0.000 |
26 |
32 |
|
[CL]B:1349 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
16690 |
37.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.124 |
33 |
|
[CL]B:1349 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
16776 |
34.2 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.124 |
34 |
|
[CL]B:1349 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
16868 |
31.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.124 |
Average: |
34.6 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.124 |
27 |
35 |
|
[D12]C:1357 |
4 |
1 |
352 |
f |
C |
x,y,z |
1_555 |
2 |
1 |
16776 |
33.9 |
0.5 |
0.267 |
0 |
0 |
0 |
0.000 |
28 |
36 |
|
C |
3 |
2 |
16776 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
4 |
3 |
16868 |
32.0 |
0.7 |
0.796 |
0 |
0 |
0 |
0.000 |
29 |
37 |
|
[D12]C:1351 |
3 |
1 |
379 |
f |
[D12]C:1349 |
x,y,z |
1_555 |
2 |
1 |
326 |
22.3 |
1.5 |
1.000 |
0 |
0 |
0 |
0.000 |
30 |
38 |
|
[D12]C:1352 |
4 |
1 |
405 |
f |
[D12]C:1348 |
x,y,z |
1_555 |
1 |
1 |
382 |
18.2 |
1.2 |
0.190 |
0 |
0 |
0 |
0.000 |
31 |
39 |
|
C |
1 |
1 |
16776 |
◊ |
A |
-x,-y,z |
2_555 |
1 |
1 |
16868 |
13.2 |
0.3 |
0.400 |
0 |
0 |
0 |
0.000 |
32 |
40 |
|
[D12]C:1352 |
2 |
1 |
405 |
f |
B |
x,y,z-1 |
1_554 |
1 |
1 |
16690 |
4.2 |
0.1 |
0.235 |
0 |
0 |
0 |
0.000 |
33 |
41 |
|
[D12]C:1350 |
1 |
1 |
297 |
f |
[D12]C:1349 |
x,y,z |
1_555 |
1 |
1 |
326 |
3.0 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|