## |
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 |
|
F |
50 |
10 |
2630 |
◊ |
E |
x,y,z |
1_555 |
45 |
10 |
2663 |
448.6 |
-4.2 |
0.678 |
23 |
0 |
0 |
0.226 |
2 |
|
D |
47 |
10 |
2641 |
◊ |
C |
x,y,z |
1_555 |
44 |
10 |
2634 |
436.6 |
-4.5 |
0.658 |
25 |
0 |
0 |
0.226 |
3 |
|
B |
42 |
10 |
2650 |
◊ |
A |
x,y,z |
1_555 |
41 |
10 |
2619 |
435.7 |
-4.0 |
0.655 |
24 |
0 |
0 |
0.226 |
Average: |
440.3 |
-4.2 |
0.664 |
24 |
0 |
0 |
0.226 |
2 |
4 |
|
E |
29 |
3 |
2663 |
x |
E |
-y+1,x-y,z-1/3 |
2_654 |
31 |
4 |
2663 |
211.8 |
7.5 |
0.952 |
2 |
0 |
0 |
0.000 |
5 |
|
C |
30 |
4 |
2634 |
x |
C |
-y,x-y-1,z-1/3 |
2_544 |
25 |
3 |
2634 |
191.7 |
6.6 |
0.941 |
1 |
0 |
0 |
0.000 |
6 |
|
A |
29 |
4 |
2619 |
x |
A |
-y,x-y,z-1/3 |
2_554 |
24 |
3 |
2619 |
183.4 |
6.6 |
0.945 |
1 |
0 |
0 |
0.000 |
Average: |
195.6 |
6.9 |
0.946 |
1 |
0 |
0 |
0.000 |
3 |
7 |
|
B |
26 |
3 |
2650 |
x |
B |
-y,x-y,z-1/3 |
2_554 |
31 |
4 |
2650 |
200.5 |
7.7 |
0.956 |
1 |
0 |
0 |
0.000 |
8 |
|
D |
24 |
3 |
2641 |
x |
D |
-y,x-y-1,z-1/3 |
2_544 |
31 |
4 |
2641 |
195.3 |
7.0 |
0.951 |
0 |
0 |
0 |
0.000 |
9 |
|
F |
29 |
4 |
2630 |
x |
F |
-y+1,x-y,z-1/3 |
2_654 |
24 |
3 |
2630 |
189.2 |
7.6 |
0.960 |
1 |
0 |
0 |
0.000 |
Average: |
195.0 |
7.4 |
0.956 |
1 |
0 |
0 |
0.000 |
4 |
10 |
|
D |
22 |
3 |
2641 |
◊ |
C |
-y,x-y-1,z-1/3 |
2_544 |
23 |
3 |
2634 |
167.1 |
-0.1 |
0.717 |
1 |
0 |
0 |
0.009 |
11 |
|
E |
22 |
3 |
2663 |
◊ |
F |
-y+1,x-y,z-1/3 |
2_654 |
20 |
3 |
2630 |
165.7 |
0.3 |
0.726 |
1 |
0 |
0 |
0.009 |
12 |
|
B |
21 |
3 |
2650 |
◊ |
A |
-y,x-y,z-1/3 |
2_554 |
19 |
3 |
2619 |
162.7 |
-0.2 |
0.700 |
1 |
0 |
0 |
0.009 |
Average: |
165.2 |
0.0 |
0.714 |
1 |
0 |
0 |
0.009 |
5 |
13 |
|
[ZN]D:101 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
4 |
1 |
2641 |
39.5 |
-21.1 |
0.000 |
0 |
0 |
0 |
0.365 |
14 |
|
[ZN]B:101 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
1 |
2650 |
38.8 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.365 |
15 |
|
[ZN]F:101 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
5 |
1 |
2630 |
36.7 |
-18.4 |
0.000 |
0 |
0 |
0 |
0.365 |
Average: |
38.3 |
-19.9 |
0.000 |
0 |
0 |
0 |
0.365 |
6 |
16 |
|
[ZN]E:101 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
4 |
1 |
2663 |
38.3 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.812 |
17 |
|
[ZN]A:101 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
1 |
2619 |
38.3 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.812 |
18 |
|
[ZN]C:101 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
5 |
1 |
2634 |
35.8 |
-17.7 |
0.000 |
0 |
0 |
0 |
0.812 |
Average: |
37.4 |
-19.2 |
0.000 |
0 |
0 |
0 |
0.812 |
7 |
19 |
|
E |
4 |
2 |
2663 |
◊ |
[ZN]F:102 |
-y+1,x-y,z-1/3 |
2_654 |
1 |
1 |
98 |
31.7 |
-15.0 |
0.000 |
0 |
0 |
0 |
0.224 |
20 |
|
[ZN]C:102 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
2634 |
30.7 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.224 |
21 |
|
[ZN]A:102 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
2619 |
29.9 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.224 |
Average: |
30.8 |
-14.2 |
0.000 |
0 |
0 |
0 |
0.224 |
8 |
22 |
|
B |
4 |
2 |
2650 |
f |
[ZN]A:102 |
-y,x-y,z-1/3 |
2_554 |
1 |
1 |
98 |
31.6 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.260 |
23 |
|
D |
4 |
2 |
2641 |
f |
[ZN]C:102 |
-y,x-y-1,z-1/3 |
2_544 |
1 |
1 |
98 |
29.9 |
-14.3 |
0.000 |
0 |
0 |
0 |
0.260 |
24 |
|
[ZN]F:102 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
2 |
1 |
2630 |
29.9 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.260 |
Average: |
30.5 |
-14.3 |
0.000 |
0 |
0 |
0 |
0.260 |
9 |
25 |
|
F |
6 |
1 |
2630 |
◊ |
E |
-y+1,x-y,z-1/3 |
2_654 |
4 |
1 |
2663 |
28.0 |
-1.1 |
0.447 |
0 |
0 |
0 |
0.000 |
26 |
|
A |
5 |
1 |
2619 |
◊ |
B |
-y,x-y,z-1/3 |
2_554 |
4 |
1 |
2650 |
24.0 |
-1.0 |
0.456 |
0 |
0 |
0 |
0.000 |
27 |
|
C |
3 |
1 |
2634 |
◊ |
D |
-y,x-y-1,z-1/3 |
2_544 |
3 |
1 |
2641 |
20.6 |
-0.8 |
0.395 |
0 |
0 |
0 |
0.000 |
Average: |
24.2 |
-1.0 |
0.433 |
0 |
0 |
0 |
0.000 |
10 |
28 |
|
[ZN]B:101 |
1 |
1 |
98 |
◊ |
D |
-y,x-y,z-1/3 |
2_554 |
3 |
1 |
2641 |
23.4 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.171 |
29 |
|
[ZN]E:101 |
1 |
1 |
98 |
◊ |
B |
-y+1,x-y,z-1/3 |
2_654 |
3 |
1 |
2650 |
18.8 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.171 |
30 |
|
F |
3 |
1 |
2630 |
◊ |
[ZN]A:101 |
-y,x-y,z-1/3 |
2_554 |
1 |
1 |
98 |
15.7 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.171 |
Average: |
19.3 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.171 |
11 |
31 |
|
C |
4 |
2 |
2634 |
◊ |
[ZN]F:101 |
-y+1,x-y,z-1/3 |
2_654 |
1 |
1 |
98 |
21.7 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.167 |
32 |
|
[ZN]D:101 |
1 |
1 |
98 |
◊ |
E |
-y,x-y-1,z-1/3 |
2_544 |
3 |
2 |
2663 |
16.1 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.167 |
Average: |
18.9 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.167 |
12 |
33 |
|
D |
2 |
2 |
2641 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
2663 |
20.2 |
-1.2 |
0.315 |
0 |
0 |
0 |
0.000 |
34 |
|
F |
2 |
2 |
2630 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
2634 |
7.1 |
-0.3 |
0.399 |
0 |
0 |
0 |
0.000 |
Average: |
13.7 |
-0.7 |
0.357 |
0 |
0 |
0 |
0.000 |
13 |
35 |
|
[ZN]B:101 |
1 |
1 |
98 |
◊ |
B |
-y,x-y,z-1/3 |
2_554 |
3 |
1 |
2650 |
18.7 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
|
[ZN]D:101 |
1 |
1 |
98 |
◊ |
D |
-y,x-y-1,z-1/3 |
2_544 |
1 |
1 |
2641 |
12.5 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.000 |
37 |
|
F |
2 |
1 |
2630 |
◊ |
[ZN]F:101 |
-y+1,x-y,z-1/3 |
2_654 |
1 |
1 |
98 |
8.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
13.1 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.000 |
14 |
38 |
|
B |
3 |
1 |
2650 |
◊ |
D |
-y,x-y,z-1/3 |
2_554 |
1 |
1 |
2641 |
18.5 |
-1.8 |
0.234 |
0 |
0 |
0 |
0.015 |
15 |
39 |
|
[ZN]E:101 |
1 |
1 |
98 |
◊ |
E |
-y+1,x-y,z-1/3 |
2_654 |
2 |
1 |
2663 |
16.5 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
|
C |
2 |
1 |
2634 |
◊ |
[ZN]C:101 |
-y,x-y-1,z-1/3 |
2_544 |
1 |
1 |
98 |
10.2 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.000 |
41 |
|
A |
2 |
1 |
2619 |
◊ |
[ZN]A:101 |
-y,x-y,z-1/3 |
2_554 |
1 |
1 |
98 |
8.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
11.8 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
16 |
42 |
|
E |
3 |
1 |
2663 |
◊ |
B |
-y+1,x-y,z-1/3 |
2_654 |
1 |
1 |
2650 |
16.1 |
-1.6 |
0.241 |
0 |
0 |
0 |
0.026 |
43 |
|
F |
2 |
1 |
2630 |
◊ |
A |
-y,x-y,z-1/3 |
2_554 |
1 |
1 |
2619 |
14.3 |
-1.5 |
0.214 |
0 |
0 |
0 |
0.026 |
Average: |
15.2 |
-1.6 |
0.228 |
0 |
0 |
0 |
0.026 |
17 |
44 |
|
A |
3 |
1 |
2619 |
◊ |
[ZN]C:101 |
-y,x-y-1,z-1/3 |
2_544 |
1 |
1 |
98 |
16.0 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.158 |
18 |
45 |
|
A |
1 |
1 |
2619 |
◊ |
C |
-y,x-y-1,z-1/3 |
2_544 |
1 |
1 |
2634 |
12.6 |
-1.4 |
0.173 |
0 |
0 |
0 |
0.030 |
19 |
46 |
|
D |
2 |
1 |
2641 |
◊ |
E |
-y,x-y-1,z-1/3 |
2_544 |
1 |
1 |
2663 |
4.1 |
-0.2 |
0.282 |
0 |
0 |
0 |
0.003 |
47 |
|
C |
1 |
1 |
2634 |
◊ |
F |
-y+1,x-y,z-1/3 |
2_654 |
1 |
1 |
2630 |
3.1 |
-0.2 |
0.300 |
0 |
0 |
0 |
0.003 |
Average: |
3.6 |
-0.2 |
0.291 |
0 |
0 |
0 |
0.003 |
|