## |
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 |
|
[8DG]D:202 |
32 |
1 |
641 |
f |
D |
x,y,z |
1_555 |
72 |
26 |
8120 |
442.7 |
0.1 |
0.609 |
12 |
0 |
0 |
0.275 |
2 |
|
[8DG]A:204 |
32 |
1 |
639 |
f |
A |
x,y,z |
1_555 |
73 |
25 |
8186 |
438.6 |
-0.1 |
0.613 |
13 |
0 |
0 |
0.275 |
3 |
|
[8DG]B:203 |
31 |
1 |
632 |
f |
B |
x,y,z |
1_555 |
66 |
24 |
8194 |
431.3 |
0.0 |
0.614 |
9 |
0 |
0 |
0.275 |
4 |
|
[8DG]C:202 |
32 |
1 |
630 |
f |
C |
x,y,z |
1_555 |
64 |
24 |
8124 |
429.8 |
0.1 |
0.612 |
10 |
0 |
0 |
0.275 |
Average: |
435.6 |
0.0 |
0.612 |
11 |
0 |
0 |
0.275 |
2 |
5 |
|
B |
46 |
13 |
8194 |
◊ |
D |
x-1,y,z |
1_455 |
43 |
12 |
8120 |
429.4 |
-1.7 |
0.478 |
9 |
2 |
0 |
0.000 |
6 |
|
A |
44 |
12 |
8186 |
◊ |
C |
x,y,z-1 |
1_554 |
43 |
12 |
8124 |
427.2 |
-1.4 |
0.509 |
9 |
2 |
0 |
0.000 |
Average: |
428.3 |
-1.6 |
0.493 |
9 |
2 |
0 |
0.000 |
3 |
7 |
|
A |
41 |
11 |
8186 |
◊ |
C |
x-1,y,z-1 |
1_454 |
41 |
11 |
8124 |
355.4 |
-2.6 |
0.379 |
8 |
6 |
0 |
0.158 |
8 |
|
B |
40 |
11 |
8194 |
◊ |
D |
x-1,y,z-1 |
1_454 |
42 |
11 |
8120 |
352.1 |
-2.6 |
0.382 |
8 |
6 |
0 |
0.158 |
Average: |
353.7 |
-2.6 |
0.381 |
8 |
6 |
0 |
0.158 |
4 |
9 |
|
C |
41 |
13 |
8124 |
◊ |
A |
x,y,z |
1_555 |
39 |
12 |
8186 |
345.1 |
2.0 |
0.792 |
5 |
0 |
0 |
0.000 |
10 |
|
D |
42 |
13 |
8120 |
◊ |
B |
x,y,z |
1_555 |
39 |
12 |
8194 |
344.0 |
2.1 |
0.798 |
5 |
0 |
0 |
0.000 |
Average: |
344.5 |
2.0 |
0.795 |
5 |
0 |
0 |
0.000 |
5 |
11 |
|
B |
30 |
12 |
8194 |
◊ |
A |
x,y,z |
1_555 |
29 |
11 |
8186 |
281.1 |
-0.8 |
0.509 |
3 |
0 |
0 |
0.000 |
6 |
12 |
|
B |
23 |
7 |
8194 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
26 |
6 |
8124 |
245.9 |
-1.6 |
0.401 |
1 |
4 |
0 |
0.077 |
13 |
|
D |
25 |
6 |
8120 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
25 |
7 |
8186 |
244.3 |
-2.0 |
0.350 |
1 |
4 |
0 |
0.077 |
Average: |
245.1 |
-1.8 |
0.375 |
1 |
4 |
0 |
0.077 |
7 |
14 |
|
[PEG]D:201 |
6 |
1 |
264 |
◊ |
D |
x,y,z |
1_555 |
12 |
6 |
8120 |
105.1 |
3.7 |
0.500 |
3 |
0 |
0 |
0.000 |
15 |
|
[PEG]A:203 |
7 |
1 |
257 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
8186 |
104.0 |
2.9 |
0.358 |
2 |
0 |
0 |
0.000 |
Average: |
104.5 |
3.3 |
0.429 |
3 |
0 |
0 |
0.000 |
8 |
16 |
|
[PEG]D:201 |
7 |
1 |
264 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
8194 |
102.1 |
1.8 |
0.231 |
3 |
0 |
0 |
0.000 |
9 |
17 |
|
[PEG]A:203 |
7 |
1 |
257 |
f |
C |
x,y,z |
1_555 |
12 |
8 |
8124 |
100.9 |
2.0 |
0.256 |
3 |
0 |
0 |
0.000 |
10 |
18 |
|
[GOL]B:202 |
5 |
1 |
217 |
f |
D |
x,y,z |
1_555 |
17 |
6 |
8120 |
93.1 |
-0.3 |
0.530 |
1 |
0 |
0 |
0.018 |
11 |
19 |
|
[GOL]B:202 |
6 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
8194 |
92.7 |
0.4 |
0.672 |
2 |
0 |
0 |
0.000 |
12 |
20 |
|
[CU]A:202 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
8186 |
53.5 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.392 |
21 |
|
B |
7 |
3 |
8194 |
f |
[CU]C:201 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
125 |
53.0 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.392 |
22 |
|
[CU]B:201 |
1 |
1 |
125 |
f |
C |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
3 |
8124 |
46.9 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.392 |
23 |
|
D |
7 |
3 |
8120 |
f |
[CU]A:201 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
125 |
46.8 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.392 |
Average: |
50.1 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.392 |
13 |
24 |
|
[CU]B:201 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
8194 |
51.5 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.189 |
25 |
|
[CU]A:201 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
8186 |
50.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.189 |
Average: |
51.2 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.189 |
14 |
26 |
|
[CU]C:201 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
8124 |
45.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.135 |
27 |
|
D |
6 |
3 |
8120 |
◊ |
[CU]A:202 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
125 |
44.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.135 |
Average: |
45.1 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.135 |
15 |
28 |
|
B |
2 |
1 |
8194 |
◊ |
C |
x-1,y,z-1 |
1_454 |
2 |
1 |
8124 |
24.6 |
-0.8 |
0.148 |
0 |
0 |
0 |
0.000 |
16 |
29 |
|
B |
3 |
1 |
8194 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
2 |
8186 |
19.9 |
0.5 |
0.778 |
0 |
0 |
0 |
0.000 |
17 |
30 |
|
[8DG]B:203 |
1 |
1 |
632 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
8186 |
0.3 |
-0.0 |
0.482 |
0 |
0 |
0 |
0.000 |
|