## |
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 |
452 |
118 |
19780 |
◊ |
A |
x,y,z |
1_555 |
453 |
116 |
19869 |
4425.6 |
-40.8 |
0.029 |
67 |
14 |
0 |
0.856 |
2 |
|
C |
445 |
117 |
19820 |
◊ |
C |
-x+1,y,-z |
2_655 |
443 |
117 |
19820 |
4377.9 |
-42.2 |
0.020 |
72 |
12 |
0 |
0.856 |
Average: |
4401.7 |
-41.5 |
0.025 |
70 |
13 |
0 |
0.856 |
2 |
3 |
|
B |
44 |
15 |
19780 |
x |
C |
x-1/2,y-1/2,z |
3_445 |
39 |
11 |
19820 |
371.5 |
3.2 |
0.868 |
5 |
2 |
0 |
0.000 |
4 |
|
C |
41 |
15 |
19820 |
x |
B |
x,y,z |
1_555 |
36 |
11 |
19780 |
352.1 |
2.7 |
0.845 |
5 |
2 |
0 |
0.000 |
5 |
|
A |
35 |
12 |
19869 |
x |
A |
-x+1/2,y-1/2,-z-1 |
4_544 |
36 |
12 |
19869 |
334.5 |
2.5 |
0.844 |
6 |
2 |
0 |
0.000 |
Average: |
352.7 |
2.8 |
0.852 |
5 |
2 |
0 |
0.000 |
3 |
6 |
|
[33G]C:503 |
30 |
1 |
604 |
f |
C |
x,y,z |
1_555 |
49 |
20 |
19820 |
354.7 |
-1.0 |
0.286 |
2 |
0 |
0 |
0.050 |
7 |
|
[33G]A:503 |
29 |
1 |
610 |
f |
A |
x,y,z |
1_555 |
51 |
19 |
19869 |
353.7 |
-0.7 |
0.349 |
2 |
0 |
0 |
0.050 |
8 |
|
[33G]B:503 |
28 |
1 |
612 |
f |
B |
x,y,z |
1_555 |
48 |
19 |
19780 |
351.5 |
-1.6 |
0.284 |
2 |
0 |
0 |
0.050 |
Average: |
353.3 |
-1.1 |
0.306 |
2 |
0 |
0 |
0.050 |
4 |
9 |
|
A |
36 |
10 |
19869 |
x |
A |
x,y-1,z |
1_545 |
33 |
9 |
19869 |
318.0 |
0.4 |
0.685 |
2 |
4 |
0 |
0.000 |
10 |
|
C |
31 |
8 |
19820 |
x |
C |
x-1/2,y-1/2,z |
3_445 |
30 |
10 |
19820 |
300.6 |
1.2 |
0.734 |
3 |
5 |
0 |
0.000 |
11 |
|
B |
30 |
8 |
19780 |
x |
B |
x-1/2,y-1/2,z |
3_445 |
34 |
10 |
19780 |
297.8 |
1.1 |
0.744 |
3 |
4 |
0 |
0.000 |
Average: |
305.5 |
0.9 |
0.721 |
3 |
4 |
0 |
0.000 |
5 |
12 |
|
[33G]B:503 |
20 |
1 |
612 |
◊ |
A |
x,y,z |
1_555 |
20 |
5 |
19869 |
172.6 |
-0.7 |
0.362 |
1 |
0 |
0 |
0.034 |
13 |
|
[33G]C:503 |
19 |
1 |
604 |
◊ |
C |
-x+1,y,-z |
2_655 |
21 |
5 |
19820 |
165.6 |
-1.1 |
0.288 |
1 |
0 |
0 |
0.034 |
14 |
|
[33G]A:503 |
18 |
1 |
610 |
◊ |
B |
x,y,z |
1_555 |
19 |
5 |
19780 |
160.8 |
-1.0 |
0.312 |
1 |
0 |
0 |
0.034 |
Average: |
166.3 |
-0.9 |
0.321 |
1 |
0 |
0 |
0.034 |
6 |
15 |
|
[BME]B:502 |
4 |
1 |
208 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
19780 |
123.9 |
-0.7 |
0.403 |
4 |
0 |
0 |
0.050 |
7 |
16 |
|
[BME]A:502 |
4 |
1 |
207 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
19869 |
122.4 |
-0.7 |
0.401 |
5 |
0 |
0 |
0.064 |
8 |
17 |
|
[BME]C:502 |
4 |
1 |
206 |
f |
C |
x,y,z |
1_555 |
20 |
9 |
19820 |
121.0 |
-0.8 |
0.393 |
5 |
0 |
0 |
0.068 |
9 |
18 |
|
A |
4 |
2 |
19869 |
x |
B |
x-1/2,y+1/2,z |
3_455 |
15 |
5 |
19780 |
61.7 |
0.5 |
0.731 |
0 |
0 |
0 |
0.000 |
19 |
|
B |
1 |
1 |
19780 |
x |
A |
x-1/2,y+1/2,z |
3_455 |
6 |
3 |
19869 |
21.1 |
0.7 |
0.694 |
0 |
0 |
0 |
0.000 |
20 |
|
C |
3 |
2 |
19820 |
x |
C |
-x+1,y-1,-z |
2_645 |
4 |
3 |
19820 |
13.5 |
-0.0 |
0.595 |
0 |
0 |
0 |
0.000 |
Average: |
32.1 |
0.4 |
0.673 |
0 |
0 |
0 |
0.000 |
10 |
21 |
|
B |
9 |
3 |
19780 |
x |
A |
x-1/2,y-1/2,z |
3_445 |
7 |
4 |
19869 |
58.3 |
-0.1 |
0.553 |
0 |
0 |
0 |
0.000 |
22 |
|
C |
7 |
3 |
19820 |
x |
C |
-x+1/2,y-1/2,-z |
4_545 |
7 |
4 |
19820 |
54.2 |
-0.0 |
0.551 |
0 |
0 |
0 |
0.000 |
23 |
|
B |
6 |
4 |
19780 |
x |
A |
x,y-1,z |
1_545 |
11 |
3 |
19869 |
50.0 |
-0.2 |
0.582 |
0 |
0 |
0 |
0.000 |
Average: |
54.2 |
-0.1 |
0.562 |
0 |
0 |
0 |
0.000 |
11 |
24 |
|
[CL]C:504 |
1 |
1 |
125 |
f |
[CL]C:504 |
-x+1,y,-z |
2_655 |
1 |
1 |
125 |
52.8 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.100 |
12 |
25 |
|
[CL]C:504 |
1 |
1 |
125 |
x |
C |
x,y,z |
1_555 |
8 |
4 |
19820 |
52.7 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.218 |
26 |
|
[CL]A:504 |
1 |
1 |
125 |
x |
A |
x,y,z |
1_555 |
8 |
4 |
19869 |
49.5 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.218 |
27 |
|
[CL]A:504 |
1 |
1 |
125 |
x |
B |
x,y,z |
1_555 |
9 |
4 |
19780 |
48.4 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.218 |
Average: |
50.2 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.218 |
|