| ## |
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 |
77 |
25 |
8266 |
◊ |
A |
-y+1,x-y+2,z |
2_675 |
73 |
27 |
8385 |
727.3 |
-4.2 |
0.664 |
9 |
4 |
0 |
0.000 |
| 2 |
2 |
|
[8OA]B:306 |
34 |
1 |
759 |
f |
B |
x,y,z |
1_555 |
66 |
21 |
8266 |
443.4 |
-2.1 |
0.421 |
4 |
0 |
0 |
0.055 |
3 |
|
[8OA]A:306 |
34 |
1 |
754 |
f |
A |
x,y,z |
1_555 |
66 |
20 |
8385 |
436.7 |
-2.0 |
0.384 |
5 |
0 |
0 |
0.055 |
| Average: |
440.1 |
-2.0 |
0.403 |
5 |
0 |
0 |
0.055 |
| 3 |
4 |
|
B |
45 |
13 |
8266 |
◊ |
A |
x,y,z |
1_555 |
41 |
13 |
8385 |
389.3 |
-5.8 |
0.275 |
3 |
1 |
0 |
0.000 |
| 4 |
5 |
|
C |
32 |
5 |
823 |
◊ |
A |
x,y,z |
1_555 |
50 |
17 |
8385 |
364.8 |
-4.8 |
0.565 |
5 |
0 |
0 |
0.094 |
6 |
|
D |
30 |
4 |
694 |
◊ |
B |
x,y,z |
1_555 |
51 |
16 |
8266 |
344.7 |
-4.8 |
0.491 |
5 |
0 |
0 |
0.094 |
| Average: |
354.8 |
-4.8 |
0.528 |
5 |
0 |
0 |
0.094 |
| 5 |
7 |
|
A |
25 |
8 |
8385 |
x |
A |
-x+y-1/3,-x+4/3,z+1/3 |
6_465 |
33 |
11 |
8385 |
266.9 |
-3.4 |
0.279 |
4 |
1 |
0 |
0.000 |
| 6 |
8 |
|
A |
20 |
6 |
8385 |
◊ |
B |
-y+5/3,x-y+7/3,z+1/3 |
5_675 |
17 |
5 |
8266 |
176.5 |
-1.6 |
0.520 |
2 |
0 |
0 |
0.000 |
| 7 |
9 |
|
B |
19 |
7 |
8266 |
◊ |
A |
x,y,z-1 |
1_554 |
14 |
5 |
8385 |
148.6 |
0.2 |
0.552 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
D |
10 |
4 |
694 |
◊ |
A |
x,y,z |
1_555 |
18 |
6 |
8385 |
120.4 |
-2.2 |
0.392 |
0 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[8OA]A:306 |
6 |
1 |
754 |
◊ |
B |
x,y,z |
1_555 |
13 |
5 |
8266 |
100.2 |
1.4 |
0.456 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
B |
10 |
4 |
8266 |
◊ |
A |
-y+1,x-y+2,z-1 |
2_674 |
13 |
5 |
8385 |
79.2 |
0.3 |
0.729 |
0 |
0 |
0 |
0.000 |
| 11 |
13 |
|
[8OA]B:306 |
10 |
1 |
759 |
◊ |
D |
x,y,z |
1_555 |
8 |
1 |
694 |
67.2 |
0.3 |
0.565 |
0 |
0 |
0 |
0.000 |
14 |
|
[8OA]A:306 |
9 |
1 |
754 |
◊ |
C |
x,y,z |
1_555 |
8 |
1 |
823 |
61.2 |
0.3 |
0.592 |
0 |
0 |
0 |
0.000 |
| Average: |
64.2 |
0.3 |
0.578 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
C |
4 |
1 |
823 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
8266 |
63.2 |
-0.9 |
0.467 |
1 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[CA]B:305 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
8266 |
45.4 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.160 |
17 |
|
[CA]A:305 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
8385 |
44.9 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.160 |
| Average: |
45.2 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.160 |
| 14 |
18 |
|
[CA]A:304 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
8385 |
44.3 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.154 |
19 |
|
[CA]B:304 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
8266 |
44.0 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.154 |
| Average: |
44.2 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.154 |
| 15 |
20 |
|
B |
3 |
1 |
8266 |
x |
B |
-y+1,x-y+2,z |
2_675 |
7 |
1 |
8266 |
43.1 |
-1.4 |
0.194 |
0 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[8OA]B:306 |
3 |
1 |
759 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
823 |
40.5 |
0.7 |
0.745 |
0 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[8OA]B:306 |
3 |
1 |
759 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
8385 |
33.8 |
0.9 |
0.274 |
0 |
0 |
0 |
0.000 |
| 18 |
23 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
8266 |
33.1 |
-22.9 |
0.000 |
0 |
0 |
0 |
0.305 |
24 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
8385 |
32.7 |
-22.5 |
0.000 |
0 |
0 |
0 |
0.305 |
| Average: |
32.9 |
-22.7 |
0.000 |
0 |
0 |
0 |
0.305 |
| 19 |
25 |
|
[8OA]B:306 |
2 |
1 |
759 |
◊ |
[8OA]A:306 |
x,y,z |
1_555 |
1 |
1 |
754 |
28.5 |
1.9 |
0.859 |
0 |
0 |
0 |
0.000 |
| 20 |
26 |
|
[ZN]B:301 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
694 |
27.4 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.160 |
27 |
|
[ZN]A:301 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
823 |
26.7 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.160 |
| Average: |
27.1 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.160 |
| 21 |
28 |
|
[8OA]A:306 |
6 |
1 |
754 |
f |
[ZN]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.4 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.064 |
29 |
|
[8OA]B:306 |
6 |
1 |
759 |
f |
[ZN]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.064 |
| Average: |
13.2 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.064 |
| 22 |
30 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
823 |
5.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.100 |
31 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
2 |
1 |
694 |
3.1 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.100 |
| Average: |
4.2 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.100 |
|